N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide

C16H16N4O — CID 10221335

IUPACN-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide
SMILESCc1cc(N)nc(CCNC(=O)c2ccc(C#N)cc2)c1
InChIInChI=1S/C16H16N4O/c1-11-8-14(20-15(18)9-11)6-7-19-16(21)13-4-2-12(10-17)3-5-13/h2-5,8-9H,6-7H2,1H3,(H2,18,20)(H,19,21)
InChIKeyQINCZVSBLITNRD-UHFFFAOYSA-N
MW280.33 g/mol
LogP1.82
Rot. Bonds4

About N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide

N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide (PubChem CID 10221335) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide.

Molecular Properties

Compound NameN-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide
PubChem CID10221335
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC NameN-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide
SMILESCc1cc(N)nc(CCNC(=O)c2ccc(C#N)cc2)c1
InChIInChI=1S/C16H16N4O/c1-11-8-14(20-15(18)9-11)6-7-19-16(21)13-4-2-12(10-17)3-5-13/h2-5,8-9H,6-7H2,1H3,(H2,18,20)(H,19,21)
InChIKeyQINCZVSBLITNRD-UHFFFAOYSA-N
XLogP1.82
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

TC-Mps1-12
CID 70682875
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2-amino-4-[[(1S)-1-(7-fluoro-4-oxo-3-phenylquinolizin-2-yl)ethyl]amino]-6-methylpyrimidine-5-carbonitrile
CID 118630968
N-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]benzamide
CID 5093257
3-cyano-N-(6-methylpyridin-2-yl)benzamide
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3-cyano-N-(6-ethylpyridin-2-yl)-5-fluorobenzamide
CID 49862385
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-((R)-3-benzyl-6-methyl-2,8-dioxo-2,3,4,8-tetrahydro-1H-[1,7]naphthyridin-7-yl)-acetamide
CID 12042269
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-(6-methyl-2-oxo-3-phenethylamino-2H-pyridin-1-yl)-acetamide
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N-[4-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]butyl]benzamide
CID 11494093
N-allyl-4-(1-((6-aminopyridin-2-yl)methyl)-5-phenyl-1H-pyrrol-2-yl)benzamide
CID 11596660
N-((cis)-4-(4-(dimethylamino)-6-methylpyrimidin-2-ylamino)cyclohexyl)-3,4-difluorobenzamide
CID 23027679
N-((cis)-4-(4-(dimethylamino)-6-methylpyrimidin-2-ylamino)cyclohexyl)-4-fluorobenzamide
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Frequently Asked Questions

What is the IUPAC name of N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide?
The IUPAC name of N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide (CID 10221335) is N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide.
What is the SMILES notation for N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide?
The canonical SMILES for N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide is Cc1cc(N)nc(CCNC(=O)c2ccc(C#N)cc2)c1.
What is the InChIKey of N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide?
The InChIKey is QINCZVSBLITNRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-11-8-14(20-15(18)9-11)6-7-19-16(21)13-4-2-12(10-17)3-5-13/h2-5,8-9H,6-7H2,1H3,(H2,18,20)(H,19,21).
What are the key properties of N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide?
N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide has a molecular weight of 280.33 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-4-cyanobenzamide is sourced from PubChem (CID 10221335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).