N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide

C16H20N4O2 — CID 166391177

IUPACN-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide
SMILESCCN1CCCC1CNC(=O)c1ccc2ccc(=O)[nH]c2n1
InChIInChI=1S/C16H20N4O2/c1-2-20-9-3-4-12(20)10-17-16(22)13-7-5-11-6-8-14(21)19-15(11)18-13/h5-8,12H,2-4,9-10H2,1H3,(H,17,22)(H,18,19,21)
InChIKeyPQRSIRRVBQERAI-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.14
Rot. Bonds4

About N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide

N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide (PubChem CID 166391177) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide
PubChem CID166391177
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC NameN-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide
SMILESCCN1CCCC1CNC(=O)c1ccc2ccc(=O)[nH]c2n1
InChIInChI=1S/C16H20N4O2/c1-2-20-9-3-4-12(20)10-17-16(22)13-7-5-11-6-8-14(21)19-15(11)18-13/h5-8,12H,2-4,9-10H2,1H3,(H,17,22)(H,18,19,21)
InChIKeyPQRSIRRVBQERAI-UHFFFAOYSA-N
XLogP1.14
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylpyrrolidin-2-yl)methyl]-6-(methylamino)pyridazine-3-carboxamide
CID 62165895
5-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]pyridine-2-carboxamide
CID 104640017
N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-4-fluorobenzamide
CID 778881
3,6-dichloro-N-[(1-ethylpyrrolidin-2-yl)methyl]pyridine-2-carboxamide
CID 43109626
N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]furan-2-carboxamide
CID 94017739
4-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]benzamide
CID 3919173
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-oxo-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide
CID 51054939
2-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]pyridine-3-carboxylic acid
CID 63614750
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-hydrazinylbenzamide
CID 62248150
3-amino-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]pyrazine-2-carboxamide
CID 94018036
N-[(1-ethylpyrrolidin-2-yl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62165372
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-fluoropyridine-3-carboxamide
CID 107358520

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide?
The IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide (CID 166391177) is N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide.
What is the SMILES notation for N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide?
The canonical SMILES for N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide is CCN1CCCC1CNC(=O)c1ccc2ccc(=O)[nH]c2n1.
What is the InChIKey of N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide?
The InChIKey is PQRSIRRVBQERAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-2-20-9-3-4-12(20)10-17-16(22)13-7-5-11-6-8-14(21)19-15(11)18-13/h5-8,12H,2-4,9-10H2,1H3,(H,17,22)(H,18,19,21).
What are the key properties of N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide?
N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-2-yl)methyl]-7-oxo-8H-1,8-naphthyridine-2-carboxamide is sourced from PubChem (CID 166391177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).