[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol

C16H21N3O — CID 79647766

IUPAC[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol
SMILESCNC1(CO)CCC(n2cc(-c3ccccc3)cn2)C1
InChIInChI=1S/C16H21N3O/c1-17-16(12-20)8-7-15(9-16)19-11-14(10-18-19)13-5-3-2-4-6-13/h2-6,10-11,15,17,20H,7-9,12H2,1H3
InChIKeyAGFKVICPMDAEBH-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.23
Rot. Bonds4

About [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol

[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol (PubChem CID 79647766) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol
PubChem CID79647766
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol
SMILESCNC1(CO)CCC(n2cc(-c3ccccc3)cn2)C1
InChIInChI=1S/C16H21N3O/c1-17-16(12-20)8-7-15(9-16)19-11-14(10-18-19)13-5-3-2-4-6-13/h2-6,10-11,15,17,20H,7-9,12H2,1H3
InChIKeyAGFKVICPMDAEBH-UHFFFAOYSA-N
XLogP2.23
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-(hydroxymethyl)-N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrrolidine-1-carboxamide
CID 84595210
(2S,3R)-2-benzyl-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-3-ol
CID 97470069
(2S,3S)-2-benzyl-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-3-ol
CID 97470406
3-(4-Fluorophenyl)-2-(3-pyrazol-1-ylpropylamino)propan-1-ol
CID 155119483
(1R,2S,3R,4R)-3-[(1-methylpyrazol-4-yl)methylamino]-4-phenylcyclopentane-1,2-diol
CID 71694040
N-[(1-methylpyrazol-4-yl)methyl]-2-(oxolan-3-yl)-1-phenylethanamine
CID 75388154
1-Benzyl-5-[[1-(1-methylpyrazol-4-yl)ethylamino]methyl]pyrrolidin-3-ol
CID 75471481
[(1R,4S)-4-[[(3-fluorophenyl)-(1-methylpyrazol-4-yl)methyl]amino]cyclopent-2-en-1-yl]methanol
CID 86787511
N-[(1-ethenylpyrazol-4-yl)methyl]-1-(oxolan-2-yl)-1-phenylmethanamine
CID 121534893
[(1S)-1-[(1-propan-2-ylpyrazol-4-yl)methylamino]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 125141383
[(2R,4S,5S)-5-(2-fluorophenyl)-1-methyl-4-[[(1-propan-2-ylpyrazol-4-yl)methylamino]methyl]pyrrolidin-2-yl]methanol
CID 164625669
(2R,3S)-3-amino-4-phenyl-1-[[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]methylamino]butan-2-ol
CID 69145565

Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol (CID 79647766) is [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol is CNC1(CO)CCC(n2cc(-c3ccccc3)cn2)C1.
What is the InChIKey of [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol?
The InChIKey is AGFKVICPMDAEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-17-16(12-20)8-7-15(9-16)19-11-14(10-18-19)13-5-3-2-4-6-13/h2-6,10-11,15,17,20H,7-9,12H2,1H3.
What are the key properties of [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol?
[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol has a molecular weight of 271.36 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol is sourced from PubChem (CID 79647766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).