N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide

C19H18N4O2 — CID 92570801

IUPACN-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide
SMILESO=C(NC[C@@H]1CCCO1)c1cc(-c2cccnc2)c2cnccc2n1
InChIInChI=1S/C19H18N4O2/c24-19(22-11-14-4-2-8-25-14)18-9-15(13-3-1-6-20-10-13)16-12-21-7-5-17(16)23-18/h1,3,5-7,9-10,12,14H,2,4,8,11H2,(H,22,24)/t14-/m0/s1
InChIKeyMNSWHVVHITTZPO-AWEZNQCLSA-N
MW334.38 g/mol
LogP2.60
Rot. Bonds4

About N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide

N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide (PubChem CID 92570801) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide
PubChem CID92570801
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide
SMILESO=C(NC[C@@H]1CCCO1)c1cc(-c2cccnc2)c2cnccc2n1
InChIInChI=1S/C19H18N4O2/c24-19(22-11-14-4-2-8-25-14)18-9-15(13-3-1-6-20-10-13)16-12-21-7-5-17(16)23-18/h1,3,5-7,9-10,12,14H,2,4,8,11H2,(H,22,24)/t14-/m0/s1
InChIKeyMNSWHVVHITTZPO-AWEZNQCLSA-N
XLogP2.60
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(oxolan-2-ylmethyl)-2-phenyl-6-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide
CID 112853570
N-[[(2S)-oxolan-2-yl]methyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093732
2-N,6-N-bis(oxolan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 4668561
N-(oxolan-2-ylmethyl)-5-phenylpyridine-2-carboxamide
CID 110683568
6-(cycloheptylamino)-N-(oxolan-2-ylmethyl)-2-phenylpyrimidine-4-carboxamide
CID 112853574
N-(oxolan-2-ylmethyl)-4-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109206754
1-[(3-fluoro-4-pyridin-3-ylphenyl)methyl]-3-(oxolan-2-ylmethyl)urea
CID 167946087
4-chloro-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81225863
N-(oxolan-2-ylmethyl)-6-phenylpyridazine-3-carboxamide
CID 113200525
4-(3-fluoro-4-pyridinyl)-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 126425082
4-amino-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81236289
N-[[(2S)-oxolan-2-yl]methyl]-2-phenylbenzamide
CID 686682

Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide?
The IUPAC name of N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide (CID 92570801) is N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide.
What is the SMILES notation for N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide?
The canonical SMILES for N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide is O=C(NC[C@@H]1CCCO1)c1cc(-c2cccnc2)c2cnccc2n1.
What is the InChIKey of N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide?
The InChIKey is MNSWHVVHITTZPO-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-19(22-11-14-4-2-8-25-14)18-9-15(13-3-1-6-20-10-13)16-12-21-7-5-17(16)23-18/h1,3,5-7,9-10,12,14H,2,4,8,11H2,(H,22,24)/t14-/m0/s1.
What are the key properties of N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide?
N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-oxolan-2-yl]methyl]-4-pyridin-3-yl-1,6-naphthyridine-2-carboxamide is sourced from PubChem (CID 92570801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).