N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide

C16H19N5O2 — CID 137205321

IUPACN-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide
SMILESO=C(NCC1CCCN(c2cc(=O)[nH]cn2)C1)c1ccccn1
InChIInChI=1S/C16H19N5O2/c22-15-8-14(19-11-20-15)21-7-3-4-12(10-21)9-18-16(23)13-5-1-2-6-17-13/h1-2,5-6,8,11-12H,3-4,7,9-10H2,(H,18,23)(H,19,20,22)
InChIKeyUXAIDSRZPHWGLT-UHFFFAOYSA-N
MW313.36 g/mol
LogP0.81
Rot. Bonds4

About N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide

N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide (PubChem CID 137205321) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide
PubChem CID137205321
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC NameN-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide
SMILESO=C(NCC1CCCN(c2cc(=O)[nH]cn2)C1)c1ccccn1
InChIInChI=1S/C16H19N5O2/c22-15-8-14(19-11-20-15)21-7-3-4-12(10-21)9-18-16(23)13-5-1-2-6-17-13/h1-2,5-6,8,11-12H,3-4,7,9-10H2,(H,18,23)(H,19,20,22)
InChIKeyUXAIDSRZPHWGLT-UHFFFAOYSA-N
XLogP0.81
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide with MolForge

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Related Compounds

N-[[(3R)-1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]-2-(1,2,4-triazol-4-yl)benzamide
CID 164631936
3-methyl-N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]furan-2-carboxamide
CID 137200016
4-[3-(ethylaminomethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136989738
4-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]-1H-pyrimidin-6-one
CID 137008019
4-(3-ethylpiperidin-1-yl)-1H-pyrimidin-6-one
CID 136957515
(3R)-1-(6-oxo-1H-pyrimidin-4-yl)piperidine-3-carboxylic acid
CID 136914108
1-(6-oxo-1H-pyrimidin-4-yl)piperidine-3-carboxylic acid;hydrochloride
CID 139026681
1-methyl-2,4-dioxo-N-[(1-pyridin-2-ylpiperidin-3-yl)methyl]pyrimidine-5-carboxamide
CID 90648225
4-methoxy-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyridine-2-carboxamide
CID 90649799
N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]-1H-pyrrole-3-carboxamide
CID 90652236
N-[(1-pyridin-2-ylpiperidin-3-yl)methyl]-2-pyrimidin-2-ylsulfanylacetamide
CID 91789394
N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-4-yl]methyl]furan-3-carboxamide
CID 137242292

Frequently Asked Questions

What is the IUPAC name of N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide?
The IUPAC name of N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide (CID 137205321) is N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide?
The canonical SMILES for N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide is O=C(NCC1CCCN(c2cc(=O)[nH]cn2)C1)c1ccccn1.
What is the InChIKey of N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide?
The InChIKey is UXAIDSRZPHWGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c22-15-8-14(19-11-20-15)21-7-3-4-12(10-21)9-18-16(23)13-5-1-2-6-17-13/h1-2,5-6,8,11-12H,3-4,7,9-10H2,(H,18,23)(H,19,20,22).
What are the key properties of N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide?
N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 137205321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).