2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide

C12H19N3O — CID 61480003

IUPAC2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1ccc(C)cn1
InChIInChI=1S/C12H19N3O/c1-4-7-13-12(16)10(3)15-11-6-5-9(2)8-14-11/h5-6,8,10H,4,7H2,1-3H3,(H,13,16)(H,14,15)
InChIKeyVZZCYYKHRCLKDU-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.72
Rot. Bonds5

About 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide

2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide (PubChem CID 61480003) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide.

Molecular Properties

Compound Name2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide
PubChem CID61480003
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1ccc(C)cn1
InChIInChI=1S/C12H19N3O/c1-4-7-13-12(16)10(3)15-11-6-5-9(2)8-14-11/h5-6,8,10H,4,7H2,1-3H3,(H,13,16)(H,14,15)
InChIKeyVZZCYYKHRCLKDU-UHFFFAOYSA-N
XLogP1.72
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide
CID 106504045
N-methyl-2-[(5-methyl-2-pyridinyl)amino]propanamide
CID 61467777
methyl 5-[[1-oxo-1-(propylamino)propan-2-yl]amino]pyrazine-2-carboxylate
CID 114059751
6-[[1-(ethylamino)-1-oxopropan-2-yl]amino]pyridine-3-carboxylic acid
CID 54959157
2-[(1-methylpyrazol-3-yl)amino]-N-propylpropanamide
CID 112723457
2-(3,5-dimethylanilino)-N-propylpropanamide
CID 43087041
2-[(6-hydrazinylpyrazin-2-yl)amino]-N-propylpropanamide
CID 80897636
5-[[1-oxo-1-(propylamino)propan-2-yl]amino]pyridine-2-carboxylic acid
CID 104638820
N-[1-oxo-1-(propylamino)propan-2-yl]-6-(propylamino)pyridine-3-carboxamide
CID 62178002
2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylpropanamide
CID 80897487
2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide
CID 119888018
(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide
CID 61147752

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide?
The IUPAC name of 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide (CID 61480003) is 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide.
What is the SMILES notation for 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide?
The canonical SMILES for 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide is CCCNC(=O)C(C)Nc1ccc(C)cn1.
What is the InChIKey of 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide?
The InChIKey is VZZCYYKHRCLKDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-7-13-12(16)10(3)15-11-6-5-9(2)8-14-11/h5-6,8,10H,4,7H2,1-3H3,(H,13,16)(H,14,15).
What are the key properties of 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide?
2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide has a molecular weight of 221.30 g/mol, XLogP of 1.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide is sourced from PubChem (CID 61480003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).