[1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol

C16H21N3O — CID 62524143

IUPAC[1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol
SMILESOCC1(NCc2ccc(-n3cccn3)cc2)CCCC1
InChIInChI=1S/C16H21N3O/c20-13-16(8-1-2-9-16)17-12-14-4-6-15(7-5-14)19-11-3-10-18-19/h3-7,10-11,17,20H,1-2,8-9,12-13H2
InChIKeyFHINIJVGQLZLAO-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.27
Rot. Bonds5

About [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol

[1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol (PubChem CID 62524143) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol
PubChem CID62524143
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name[1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol
SMILESOCC1(NCc2ccc(-n3cccn3)cc2)CCCC1
InChIInChI=1S/C16H21N3O/c20-13-16(8-1-2-9-16)17-12-14-4-6-15(7-5-14)19-11-3-10-18-19/h3-7,10-11,17,20H,1-2,8-9,12-13H2
InChIKeyFHINIJVGQLZLAO-UHFFFAOYSA-N
XLogP2.27
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentane-1-carboxylic acid
CID 136516250
2-[4-[(4-pyrazol-1-ylphenyl)methylamino]oxan-4-yl]ethanol
CID 71849564
1-amino-N-[(4-pyrazol-1-ylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119290430
[1-[(1-phenylpyrazol-4-yl)methylamino]cyclopentyl]methanol
CID 62523609
2-[(4-pyrazol-1-ylphenyl)methylamino]propane-1,3-diol
CID 65310420
2,2-dimethyl-N-[(4-pyrazol-1-ylphenyl)methyl]cyclohexan-1-amine
CID 79857291
N-[(4-pyrazol-1-ylphenyl)methyl]piperidin-1-amine
CID 83006670
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[(4-pyrazol-1-ylphenyl)methyl]acetamide
CID 55698077
2-[(4-pyrazol-1-ylphenyl)methylamino]cyclohexan-1-ol
CID 60612400
[1-[[4-(difluoromethyl)phenyl]methylamino]cyclohexyl]methanol
CID 115523953
[1-[(1-methylpyrrol-3-yl)methylamino]cyclopentyl]methanol
CID 66400247
4-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]benzamide
CID 62522600

Frequently Asked Questions

What is the IUPAC name of [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol?
The IUPAC name of [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol (CID 62524143) is [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol is OCC1(NCc2ccc(-n3cccn3)cc2)CCCC1.
What is the InChIKey of [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol?
The InChIKey is FHINIJVGQLZLAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c20-13-16(8-1-2-9-16)17-12-14-4-6-15(7-5-14)19-11-3-10-18-19/h3-7,10-11,17,20H,1-2,8-9,12-13H2.
What are the key properties of [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol?
[1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol has a molecular weight of 271.36 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-pyrazol-1-ylphenyl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 62524143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).