N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide

C16H24N4O3 — CID 124892168

IUPACN-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide
SMILESCN1CCN(NC(=O)c2ccc(OC[C@@H]3CCCO3)nc2)CC1
InChIInChI=1S/C16H24N4O3/c1-19-6-8-20(9-7-19)18-16(21)13-4-5-15(17-11-13)23-12-14-3-2-10-22-14/h4-5,11,14H,2-3,6-10,12H2,1H3,(H,18,21)/t14-/m0/s1
InChIKeyNPXYQBLCABNWDO-AWEZNQCLSA-N
MW320.39 g/mol
LogP0.53
Rot. Bonds5

About N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide

N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide (PubChem CID 124892168) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide
PubChem CID124892168
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC NameN-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide
SMILESCN1CCN(NC(=O)c2ccc(OC[C@@H]3CCCO3)nc2)CC1
InChIInChI=1S/C16H24N4O3/c1-19-6-8-20(9-7-19)18-16(21)13-4-5-15(17-11-13)23-12-14-3-2-10-22-14/h4-5,11,14H,2-3,6-10,12H2,1H3,(H,18,21)/t14-/m0/s1
InChIKeyNPXYQBLCABNWDO-AWEZNQCLSA-N
XLogP0.53
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-dimethyl-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
CID 121017281
N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
CID 119100066
N-(3-tert-butyl-1,2-oxazol-5-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide
CID 124891285
6-[[(2S)-oxolan-2-yl]methoxy]-N-pyridin-2-ylpyridine-3-carboxamide
CID 124892848
N-[(4-fluorophenyl)methyl]-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
CID 121017286
6-[[(2S)-oxolan-2-yl]methoxy]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 124725193
6-(oxolan-2-ylmethoxy)pyridine-3-carbothioamide
CID 24702377
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide
CID 124891661
ethyl 2-[[6-(oxolan-2-ylmethoxy)pyridine-3-carbonyl]amino]-1,3-thiazole-4-carboxylate
CID 121017310
[4-(2,3-dimethylphenyl)piperazin-1-yl]-[6-(oxolan-2-ylmethoxy)-3-pyridinyl]methanone
CID 121017308
N-[3-(difluoromethoxy)phenyl]-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
CID 121017303
[6-(oxolan-2-ylmethoxy)-3-pyridinyl]methanol
CID 61255283

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide?
The IUPAC name of N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide (CID 124892168) is N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide.
What is the SMILES notation for N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide?
The canonical SMILES for N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide is CN1CCN(NC(=O)c2ccc(OC[C@@H]3CCCO3)nc2)CC1.
What is the InChIKey of N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide?
The InChIKey is NPXYQBLCABNWDO-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H24N4O3/c1-19-6-8-20(9-7-19)18-16(21)13-4-5-15(17-11-13)23-12-14-3-2-10-22-14/h4-5,11,14H,2-3,6-10,12H2,1H3,(H,18,21)/t14-/m0/s1.
What are the key properties of N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide?
N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide has a molecular weight of 320.39 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperazin-1-yl)-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide is sourced from PubChem (CID 124892168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).