N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide

C15H18N4O — CID 105070941

IUPACN-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide
SMILESCCc1cccnc1CNC(=O)c1ccncc1NC
InChIInChI=1S/C15H18N4O/c1-3-11-5-4-7-18-13(11)10-19-15(20)12-6-8-17-9-14(12)16-2/h4-9,16H,3,10H2,1-2H3,(H,19,20)
InChIKeyQOFCOEMORZLOTI-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.01
Rot. Bonds5

About N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide

N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide (PubChem CID 105070941) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide
PubChem CID105070941
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide
SMILESCCc1cccnc1CNC(=O)c1ccncc1NC
InChIInChI=1S/C15H18N4O/c1-3-11-5-4-7-18-13(11)10-19-15(20)12-6-8-17-9-14(12)16-2/h4-9,16H,3,10H2,1-2H3,(H,19,20)
InChIKeyQOFCOEMORZLOTI-UHFFFAOYSA-N
XLogP2.01
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide
CID 82733988
N-ethyl-3-(methylamino)pyridine-4-carboxamide
CID 105068179
N-[(3-ethyl-2-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 82744064
N-[(3-ethylthiophen-2-yl)methyl]-3-(methylamino)pyridine-4-carboxamide
CID 105070736
N-[(2-ethylphenyl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 81245012
N-[(3-ethyl-2-pyridinyl)methyl]-4-(methylamino)benzamide
CID 82743343
N-[(3-ethyl-2-pyridinyl)methyl]-5-hydroxypyridine-3-carboxamide
CID 82739232
N-[(3-ethyl-2-pyridinyl)methyl]-2H-triazole-4-carboxamide
CID 82748926
N-[(3-ethyl-2-pyridinyl)methyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 82734476
2,6-dichloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 106994204
2-bromo-N-[(3-ethyl-2-pyridinyl)methyl]furan-3-carboxamide
CID 106854223
2-amino-5-bromo-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 82743986

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide?
The IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide (CID 105070941) is N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide is CCc1cccnc1CNC(=O)c1ccncc1NC.
What is the InChIKey of N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide?
The InChIKey is QOFCOEMORZLOTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-3-11-5-4-7-18-13(11)10-19-15(20)12-6-8-17-9-14(12)16-2/h4-9,16H,3,10H2,1-2H3,(H,19,20).
What are the key properties of N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide?
N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105070941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).