[1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone

C12H19N3O — CID 103130453

IUPAC[1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone
SMILESCN(C)C1(C(=O)c2ccn(C)n2)CCCC1
InChIInChI=1S/C12H19N3O/c1-14(2)12(7-4-5-8-12)11(16)10-6-9-15(3)13-10/h6,9H,4-5,7-8H2,1-3H3
InChIKeyLCQZSVFHGPGKPR-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.48
Rot. Bonds3

About [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone

[1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone (PubChem CID 103130453) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone.

Molecular Properties

Compound Name[1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone
PubChem CID103130453
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone
SMILESCN(C)C1(C(=O)c2ccn(C)n2)CCCC1
InChIInChI=1S/C12H19N3O/c1-14(2)12(7-4-5-8-12)11(16)10-6-9-15(3)13-10/h6,9H,4-5,7-8H2,1-3H3
InChIKeyLCQZSVFHGPGKPR-UHFFFAOYSA-N
XLogP1.48
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(dimethylamino)cycloheptyl]-2-(1-methylpyrazol-3-yl)ethanone
CID 82869126
[1-(dimethylamino)cyclohexyl]-(1-methylpyrazol-4-yl)methanone
CID 79066934
N-[[1-(aminomethyl)cyclopentyl]methyl]-1-methylpyrazole-3-carboxamide
CID 103123164
(2,2-dimethylpyrrolidin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 141314396
N-[1-(hydroxymethyl)cyclopropyl]-1-methylpyrazole-3-carboxamide
CID 103881085
1-methylpyrazole-3-carboxamide
CID 13464586
(4-chloro-1-methylpyrazol-5-yl)-[1-(dimethylamino)cyclohexyl]methanone
CID 114641258
(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone
CID 19577577
(3R)-N,N,3-trimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide
CID 95815536
(1-methylpyrazol-3-yl)-(4-propylpiperidin-4-yl)methanone
CID 103133140
[1-(dimethylamino)cyclopentyl]-(1-methylindol-3-yl)methanone
CID 14069774
[1-(dimethylamino)cyclohexyl]-(6-methyl-3-pyridinyl)methanone
CID 79066112

Frequently Asked Questions

What is the IUPAC name of [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone?
The IUPAC name of [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone (CID 103130453) is [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone.
What is the SMILES notation for [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone?
The canonical SMILES for [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone is CN(C)C1(C(=O)c2ccn(C)n2)CCCC1.
What is the InChIKey of [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone?
The InChIKey is LCQZSVFHGPGKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-14(2)12(7-4-5-8-12)11(16)10-6-9-15(3)13-10/h6,9H,4-5,7-8H2,1-3H3.
What are the key properties of [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone?
[1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone has a molecular weight of 221.30 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(dimethylamino)cyclopentyl]-(1-methylpyrazol-3-yl)methanone is sourced from PubChem (CID 103130453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).