3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide

C10H12N4O — CID 114765879

IUPAC3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide
SMILESCc1cc(C#N)cc(NCCC(N)=O)n1
InChIInChI=1S/C10H12N4O/c1-7-4-8(6-11)5-10(14-7)13-3-2-9(12)15/h4-5H,2-3H2,1H3,(H2,12,15)(H,13,14)
InChIKeyBFCWCPLPMCUQHO-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.55
Rot. Bonds4

About 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide

3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide (PubChem CID 114765879) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide.

Molecular Properties

Compound Name3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide
PubChem CID114765879
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide
SMILESCc1cc(C#N)cc(NCCC(N)=O)n1
InChIInChI=1S/C10H12N4O/c1-7-4-8(6-11)5-10(14-7)13-3-2-9(12)15/h4-5H,2-3H2,1H3,(H2,12,15)(H,13,14)
InChIKeyBFCWCPLPMCUQHO-UHFFFAOYSA-N
XLogP0.55
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-cyano-6-methyl-2-pyridinyl)amino]butanamide
CID 114765908
2-[(4-cyano-6-methyl-2-pyridinyl)amino]ethylurea
CID 114766555
3-[(4-cyano-6-methyl-2-pyridinyl)amino]-N-methylpropanamide
CID 114766134
methyl 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanoate
CID 114765934
2-[(4-cyano-6-methyl-2-pyridinyl)amino]ethyl carbamate
CID 114766558
4-[2-[(4-cyano-6-methyl-2-pyridinyl)amino]ethyl]heptanoic acid
CID 114765429
2-methyl-6-(pentylamino)pyridine-4-carbonitrile
CID 114765696
3-[[2-(ethylamino)-6-methylpyrimidin-4-yl]amino]propanamide
CID 80787003
2-[(4-cyano-6-methyl-2-pyridinyl)amino]-N,N-dimethylethanesulfonamide
CID 106338610
2-[2-(4-hydroxyphenyl)ethylamino]-6-methylpyridine-4-carbonitrile
CID 114765933
2-(2,2-dimethylbutylamino)-6-methylpyridine-4-carbonitrile
CID 103461768
3-[(6-cyanopyrimidin-4-yl)amino]propanamide
CID 126973504

Frequently Asked Questions

What is the IUPAC name of 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide?
The IUPAC name of 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide (CID 114765879) is 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide.
What is the SMILES notation for 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide?
The canonical SMILES for 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide is Cc1cc(C#N)cc(NCCC(N)=O)n1.
What is the InChIKey of 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide?
The InChIKey is BFCWCPLPMCUQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-7-4-8(6-11)5-10(14-7)13-3-2-9(12)15/h4-5H,2-3H2,1H3,(H2,12,15)(H,13,14).
What are the key properties of 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide?
3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide has a molecular weight of 204.23 g/mol, XLogP of 0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-cyano-6-methyl-2-pyridinyl)amino]propanamide is sourced from PubChem (CID 114765879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).