2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine

C84H207N23O8 — CID 158208713

About 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine

2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine (PubChem CID 158208713) has the molecular formula C84H207N23O8 and a molecular weight of 1667.73 g/mol. Its IUPAC name is 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine.

Molecular Properties

• Compound Name: 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine
• PubChem CID: 158208713
• Molecular Formula: C84H207N23O8
• Molecular Weight: 1667.73 g/mol
• Exact Mass: 1666.65
• IUPAC Name: 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine
• SMILES: CCC(N)CO.CCCCC(CC)CN.CCCCCCN.CCCCN.CN(C)CCCN.CN(C)CCN.NCC1CC1.NCC1CCCCC1.NCCCCCCO.NCCCCO.NCCCN1CCOCC1.NCCCn1ccnc1.NCCN1CCCCC1.NCCN1CCOCC1.NCCO.NCCOCCO
• InChI: InChI=1S/C8H19N.C7H16N2O.C7H16N2.C7H15N.C6H11N3.C6H14N2O.C6H15NO.C6H15N.C5H14N2.C4H12N2.C4H11NO2.2C4H11NO.C4H9N.C4H11N.C2H7NO/c1-3-5-6-8(4-2)7-9;8-2-1-3-9-4-6-10-7-5-9;8-4-7-9-5-2-1-3-6-9;8-6-7-4-2-1-3-5-7;7-2-1-4-9-5-3-8-6-9;7-1-2-8-3-5-9-6-4-8;7-5-3-1-2-4-6-8;1-2-3-4-5-6-7;1-7(2)5-3-4-6;1-6(2)4-3-5;5-1-3-7-4-2-6;1-2-4(5)3-6;5-3-1-2-4-6;5-3-4-1-2-4;1-2-3-4-5;3-1-2-4/h8H,3-7,9H2,1-2H3;1-8H2;1-8H2;7H,1-6,8H2;3,5-6H,1-2,4,7H2;1-7H2;8H,1-7H2;2-7H2,1H3;3-6H2,1-2H3;3-5H2,1-2H3;6H,1-5H2;4,6H,2-3,5H2,1H3;6H,1-5H2;4H,1-3,5H2;2-5H2,1H3;4H,1-3H2
• InChIKey: GBUOFKYZHJXEMZ-UHFFFAOYSA-N
• XLogP: 3.15
• TPSA: 579.18 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 31
• Rotatable Bonds: 43
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1667.73
LogP ≤ 5	3.15
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine?

The IUPAC name of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine (CID 158208713) is 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine.

What is the SMILES notation for 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine?

The canonical SMILES for 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine is CCC(N)CO.CCCCC(CC)CN.CCCCCCN.CCCCN.CN(C)CCCN.CN(C)CCN.NCC1CC1.NCC1CCCCC1.NCCCCCCO.NCCCCO.NCCCN1CCOCC1.NCCCn1ccnc1.NCCN1CCCCC1.NCCN1CCOCC1.NCCO.NCCOCCO.

What is the InChIKey of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine?

The InChIKey is GBUOFKYZHJXEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C7H16N2O.C7H16N2.C7H15N.C6H11N3.C6H14N2O.C6H15NO.C6H15N.C5H14N2.C4H12N2.C4H11NO2.2C4H11NO.C4H9N.C4H11N.C2H7NO/c1-3-5-6-8(4-2)7-9;8-2-1-3-9-4-6-10-7-5-9;8-4-7-9-5-2-1-3-6-9;8-6-7-4-2-1-3-5-7;7-2-1-4-9-5-3-8-6-9;7-1-2-8-3-5-9-6-4-8;7-5-3-1-2-4-6-8;1-2-3-4-5-6-7;1-7(2)5-3-4-6;1-6(2)4-3-5;5-1-3-7-4-2-6;1-2-4(5)3-6;5-3-1-2-4-6;5-3-4-1-2-4;1-2-3-4-5;3-1-2-4/h8H,3-7,9H2,1-2H3;1-8H2;1-8H2;7H,1-6,8H2;3,5-6H,1-2,4,7H2;1-7H2;8H,1-7H2;2-7H2,1H3;3-6H2,1-2H3;3-5H2,1-2H3;6H,1-5H2;4,6H,2-3,5H2,1H3;6H,1-5H2;4H,1-3,5H2;2-5H2,1H3;4H,1-3H2.

What are the key properties of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine?

2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine has a molecular weight of 1667.73 g/mol, XLogP of 3.15, 43 rotatable bonds, 21 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminoethanol;2-(2-aminoethoxy)ethanol;6-aminohexan-1-ol;butan-1-amine;cyclohexylmethanamine;cyclopropylmethanamine;N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;2-ethylhexan-1-amine;hexan-1-amine;3-imidazol-1-ylpropan-1-amine;2-morpholin-4-ylethanamine;3-morpholin-4-ylpropan-1-amine;2-piperidin-1-ylethanamine is sourced from PubChem (CID 158208713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).