N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide

C16H19N3O2 — CID 95189773

IUPACN-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide
SMILESCN(C[C@@H]1CCCCO1)C(=O)c1ccc2cccnc2n1
InChIInChI=1S/C16H19N3O2/c1-19(11-13-6-2-3-10-21-13)16(20)14-8-7-12-5-4-9-17-15(12)18-14/h4-5,7-9,13H,2-3,6,10-11H2,1H3/t13-/m0/s1
InChIKeyPYHCWAFUAARUPY-ZDUSSCGKSA-N
MW285.35 g/mol
LogP2.27
Rot. Bonds3

About N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide

N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide (PubChem CID 95189773) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide
PubChem CID95189773
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide
SMILESCN(C[C@@H]1CCCCO1)C(=O)c1ccc2cccnc2n1
InChIInChI=1S/C16H19N3O2/c1-19(11-13-6-2-3-10-21-13)16(20)14-8-7-12-5-4-9-17-15(12)18-14/h4-5,7-9,13H,2-3,6,10-11H2,1H3/t13-/m0/s1
InChIKeyPYHCWAFUAARUPY-ZDUSSCGKSA-N
XLogP2.27
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 55052209
N-methyl-N-[[(2R)-oxan-2-yl]methyl]-2-propan-2-ylpyrimidine-4-carboxamide
CID 95550396
4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide
CID 126435144
5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 81315666
2-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-3-carboxamide
CID 62179768
N-methyl-N-[[(2S)-oxan-2-yl]methyl]-2-pyridin-2-ylpyrimidine-5-carboxamide
CID 95551213
N-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4-carboxamide
CID 127943943
N-methyl-N-(oxan-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 55218707
5-chloro-N-methyl-N-(oxan-2-ylmethyl)pyrazine-2-carboxamide
CID 107252486
N-methyl-2-(methylamino)-N-(oxan-2-ylmethyl)benzamide
CID 61436480
2-fluoro-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 61435800
N-methyl-N-[[(2R)-oxan-2-yl]methyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 95217132

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide?
The IUPAC name of N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide (CID 95189773) is N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide.
What is the SMILES notation for N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide?
The canonical SMILES for N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide is CN(C[C@@H]1CCCCO1)C(=O)c1ccc2cccnc2n1.
What is the InChIKey of N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide?
The InChIKey is PYHCWAFUAARUPY-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-19(11-13-6-2-3-10-21-13)16(20)14-8-7-12-5-4-9-17-15(12)18-14/h4-5,7-9,13H,2-3,6,10-11H2,1H3/t13-/m0/s1.
What are the key properties of N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide?
N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide is sourced from PubChem (CID 95189773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).