N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide

C13H18N2O3 — CID 115760175

IUPACN-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCN(CC1(O)CCCC1)C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H18N2O3/c1-15(9-13(18)6-2-3-7-13)12(17)10-4-5-11(16)14-8-10/h4-5,8,18H,2-3,6-7,9H2,1H3,(H,14,16)
InChIKeyYDPDADLDTKFXJE-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.75
Rot. Bonds3

About N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide

N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 115760175) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide
PubChem CID115760175
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCN(CC1(O)CCCC1)C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H18N2O3/c1-15(9-13(18)6-2-3-7-13)12(17)10-4-5-11(16)14-8-10/h4-5,8,18H,2-3,6-7,9H2,1H3,(H,14,16)
InChIKeyYDPDADLDTKFXJE-UHFFFAOYSA-N
XLogP0.75
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-N-methyl-2H-benzotriazole-5-carboxamide
CID 115759787
N-[(1-hydroxycyclopentyl)methyl]-N-methylfuran-3-carboxamide
CID 115760185
1-N-tert-butyl-4-N-[(1-hydroxycyclopentyl)methyl]-4-N-methylbenzene-1,4-dicarboxamide
CID 71910915
3-[methyl-(6-oxo-1H-pyridine-3-carbonyl)amino]propanoic acid
CID 60989966
N-[(4-fluorophenyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 4803573
6-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methyl-1H-indole-3-carboxamide
CID 114946750
4-[(1-hydroxycyclopentyl)methyl-methylcarbamoyl]pyridine-2-carboxylic acid
CID 114951144
N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 79652401
methyl 3-[methyl-(6-oxo-1H-pyridine-3-carbonyl)amino]propanoate
CID 54980402
4-hydroxy-N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylbenzamide
CID 103867312
5-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methyl-1H-pyrazole-4-carboxamide
CID 114951112
4-chloro-N-[(1-hydroxycyclopentyl)methyl]-N-methylpyridine-2-carboxamide
CID 113322275

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide (CID 115760175) is N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide is CN(CC1(O)CCCC1)C(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is YDPDADLDTKFXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-15(9-13(18)6-2-3-7-13)12(17)10-4-5-11(16)14-8-10/h4-5,8,18H,2-3,6-7,9H2,1H3,(H,14,16).
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide?
N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 115760175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).