1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine

C130H180F5N27O3 — CID 161429652

About 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine

1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine (PubChem CID 161429652) has the molecular formula C130H180F5N27O3 and a molecular weight of 2264.05 g/mol. Its IUPAC name is 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine.

Molecular Properties

• Compound Name: 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine
• PubChem CID: 161429652
• Molecular Formula: C130H180F5N27O3
• Molecular Weight: 2264.05 g/mol
• Exact Mass: 2262.47
• IUPAC Name: 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine
• SMILES: C.CC(=O)C(N)c1cccnc1.CC(C)c1ncccc1CN.CC(N)c1ccccc1.CC(N)c1ccccn1.CCc1ccc(C(C)C)nc1.CCc1ccc(F)nc1.CCc1cccnc1C(F)(F)F.CCc1cncc(C(C)C)c1.CCc1cncc(C)c1.COc1ccc(CN)cn1.COc1ncccc1CN.Cc1ncccc1CN.NCCc1ccccc1.NCCc1ccccn1.NCc1ccccn1.NCc1cccnc1.NCc1cccnc1F
• InChI: InChI=1S/2C10H15N.C9H14N2.C8H8F3N.C8H10N2O.3C8H11N.C7H8FN.2C7H10N2O.3C7H10N2.C6H7FN2.2C6H8N2.CH4/c1-4-9-5-10(8(2)3)7-11-6-9;1-4-9-5-6-10(8(2)3)11-7-9;1-7(2)9-8(6-10)4-3-5-11-9;1-2-6-4-3-5-12-7(6)8(9,10)11;1-6(11)8(9)7-3-2-4-10-5-7;1-7(9)8-5-3-2-4-6-8;1-3-8-4-7(2)5-9-6-8;9-7-6-8-4-2-1-3-5-8;1-2-6-3-4-7(8)9-5-6;1-10-7-3-2-6(4-8)5-9-7;1-10-7-6(5-8)3-2-4-9-7;1-6-7(5-8)3-2-4-9-6;1-6(8)7-4-2-3-5-9-7;8-5-4-7-3-1-2-6-9-7;7-6-5(4-8)2-1-3-9-6;7-4-6-2-1-3-8-5-6;7-5-6-3-1-2-4-8-6;/h2*5-8H,4H2,1-3H3;3-5,7H,6,10H2,1-2H3;3-5H,2H2,1H3;2-5,8H,9H2,1H3;2-7H,9H2,1H3;4-6H,3H2,1-2H3;1-5H,6-7,9H2;3-5H,2H2,1H3;2-3,5H,4,8H2,1H3;2-4H,5,8H2,1H3;2-4H,5,8H2,1H3;2-6H,8H2,1H3;1-3,6H,4-5,8H2;1-3H,4,8H2;1-3,5H,4,7H2;1-4H,5,7H2;1H4
• InChIKey: VXVLZISBSCRZPU-UHFFFAOYSA-N
• XLogP: 23.19
• TPSA: 541.12 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 30
• Rotatable Bonds: 25
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2264.05
LogP ≤ 5	23.19
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine?

The IUPAC name of 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine (CID 161429652) is 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine.

What is the SMILES notation for 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine?

The canonical SMILES for 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine is C.CC(=O)C(N)c1cccnc1.CC(C)c1ncccc1CN.CC(N)c1ccccc1.CC(N)c1ccccn1.CCc1ccc(C(C)C)nc1.CCc1ccc(F)nc1.CCc1cccnc1C(F)(F)F.CCc1cncc(C(C)C)c1.CCc1cncc(C)c1.COc1ccc(CN)cn1.COc1ncccc1CN.Cc1ncccc1CN.NCCc1ccccc1.NCCc1ccccn1.NCc1ccccn1.NCc1cccnc1.NCc1cccnc1F.

What is the InChIKey of 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine?

The InChIKey is VXVLZISBSCRZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H15N.C9H14N2.C8H8F3N.C8H10N2O.3C8H11N.C7H8FN.2C7H10N2O.3C7H10N2.C6H7FN2.2C6H8N2.CH4/c1-4-9-5-10(8(2)3)7-11-6-9;1-4-9-5-6-10(8(2)3)11-7-9;1-7(2)9-8(6-10)4-3-5-11-9;1-2-6-4-3-5-12-7(6)8(9,10)11;1-6(11)8(9)7-3-2-4-10-5-7;1-7(9)8-5-3-2-4-6-8;1-3-8-4-7(2)5-9-6-8;9-7-6-8-4-2-1-3-5-8;1-2-6-3-4-7(8)9-5-6;1-10-7-3-2-6(4-8)5-9-7;1-10-7-6(5-8)3-2-4-9-7;1-6-7(5-8)3-2-4-9-6;1-6(8)7-4-2-3-5-9-7;8-5-4-7-3-1-2-6-9-7;7-6-5(4-8)2-1-3-9-6;7-4-6-2-1-3-8-5-6;7-5-6-3-1-2-4-8-6;/h2*5-8H,4H2,1-3H3;3-5,7H,6,10H2,1-2H3;3-5H,2H2,1H3;2-5,8H,9H2,1H3;2-7H,9H2,1H3;4-6H,3H2,1-2H3;1-5H,6-7,9H2;3-5H,2H2,1H3;2-3,5H,4,8H2,1H3;2-4H,5,8H2,1H3;2-4H,5,8H2,1H3;2-6H,8H2,1H3;1-3,6H,4-5,8H2;1-3H,4,8H2;1-3,5H,4,7H2;1-4H,5,7H2;1H4.

What are the key properties of 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine?

1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine has a molecular weight of 2264.05 g/mol, XLogP of 23.19, 25 rotatable bonds, 12 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 1-amino-1-pyridin-3-ylpropan-2-one;5-ethyl-2-fluoropyridine;3-ethyl-5-methylpyridine;3-ethyl-5-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;3-ethyl-2-(trifluoromethyl)pyridine;(2-fluoro-3-pyridinyl)methanamine;methane;(2-methoxy-3-pyridinyl)methanamine;(6-methoxy-3-pyridinyl)methanamine;(2-methyl-3-pyridinyl)methanamine;1-phenylethanamine;2-phenylethanamine;(2-propan-2-yl-3-pyridinyl)methanamine;1-pyridin-2-ylethanamine;2-pyridin-2-ylethanamine;pyridin-2-ylmethanamine;pyridin-3-ylmethanamine is sourced from PubChem (CID 161429652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).