N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide

C12H19N3O2 — CID 113236280

IUPACN-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCC2(O)CCCC2)nn1C
InChIInChI=1S/C12H19N3O2/c1-9-7-10(14-15(9)2)11(16)13-8-12(17)5-3-4-6-12/h7,17H,3-6,8H2,1-2H3,(H,13,16)
InChIKeyGLZWQMHDHQTPND-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.76
Rot. Bonds3

About N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide

N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide (PubChem CID 113236280) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide
PubChem CID113236280
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCC2(O)CCCC2)nn1C
InChIInChI=1S/C12H19N3O2/c1-9-7-10(14-15(9)2)11(16)13-8-12(17)5-3-4-6-12/h7,17H,3-6,8H2,1-2H3,(H,13,16)
InChIKeyGLZWQMHDHQTPND-UHFFFAOYSA-N
XLogP0.76
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-1-methyl-5-propan-2-ylpyrazole-3-carboxamide
CID 111560347
1-[[(1,5-dimethylpyrazole-3-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 120543687
N-[(1-hydroxycyclohexyl)methyl]-2,5-dimethylpyrazole-3-carboxamide
CID 66126067
N-[(1-hydroxy-3,4-dihydro-2H-naphthalen-1-yl)methyl]-1,5-dimethylpyrazole-3-carboxamide
CID 111110498
3-ethyl-N-[(1-hydroxycyclopentyl)methyl]-1-methylpyrazole-5-carboxamide
CID 66121924
N-(2-methoxyethyl)-1,5-dimethylpyrazole-3-carboxamide
CID 19279762
4-[(1,5-dimethylpyrazole-3-carbonyl)amino]butanoyl chloride
CID 19279626
4-amino-N-[(1-hydroxycyclohexyl)methyl]-1,3-dimethylpyrazole-5-carboxamide
CID 66123246
N-carbamoyl-1,5-dimethylpyrazole-3-carboxamide
CID 130485672
N-[(1-hydroxycyclohexyl)methyl]-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 111485768
N-[(1-hydroxycyclobutyl)methyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 115643362
1,5-dimethyl-N-[(6-methylpiperidin-2-yl)methyl]pyrazole-3-carboxamide
CID 114218950

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide (CID 113236280) is N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide is Cc1cc(C(=O)NCC2(O)CCCC2)nn1C.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide?
The InChIKey is GLZWQMHDHQTPND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-9-7-10(14-15(9)2)11(16)13-8-12(17)5-3-4-6-12/h7,17H,3-6,8H2,1-2H3,(H,13,16).
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide?
N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide has a molecular weight of 237.30 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-1,5-dimethylpyrazole-3-carboxamide is sourced from PubChem (CID 113236280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).