1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea

C15H18N4O — CID 110469840

IUPAC1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea
SMILESO=C(Nc1ccn[nH]1)NC1(c2ccccc2)CCCC1
InChIInChI=1S/C15H18N4O/c20-14(17-13-8-11-16-19-13)18-15(9-4-5-10-15)12-6-2-1-3-7-12/h1-3,6-8,11H,4-5,9-10H2,(H3,16,17,18,19,20)
InChIKeyQEZIEUPLLRIBCM-UHFFFAOYSA-N
MW270.34 g/mol
LogP3.00
Rot. Bonds3

About 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea

1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea (PubChem CID 110469840) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea.

Molecular Properties

Compound Name1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea
PubChem CID110469840
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea
SMILESO=C(Nc1ccn[nH]1)NC1(c2ccccc2)CCCC1
InChIInChI=1S/C15H18N4O/c20-14(17-13-8-11-16-19-13)18-15(9-4-5-10-15)12-6-2-1-3-7-12/h1-3,6-8,11H,4-5,9-10H2,(H3,16,17,18,19,20)
InChIKeyQEZIEUPLLRIBCM-UHFFFAOYSA-N
XLogP3.00
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 53.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-diphenyl-5-[(1H-pyrazol-3-yl)amino]pyrazolo[1,5-a]pyrimidin-7(4H)-one
CID 155899158
Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-
CID 3001115
Pyrazole, 3-acetamido-4-phenyl-
CID 3046679
Urea, (4-phenylpyrazol-3-yl)-
CID 24847591
2-acetamido-N-benzyl-2-(1H-pyrazol-5-ylamino)acetamide
CID 14860696
Methyl 2,2,2-trifluoro-1-(5-pyrazolylamino)-1-(4-tolyl)ethylcarbamate
CID 129738570
1-[1-(2-Methoxyethyl)pyrazol-3-yl]-3-(1-phenylcyclopentyl)urea
CID 72014512
1-[2-methyl-5-(2-methylpyrazol-3-yl)phenyl]-3-(1H-pyrazol-5-yl)urea
CID 122150319
1-(3-fluorophenyl)-3-(1H-pyrazol-5-yl)urea
CID 61394443
1-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]-3-[4-[(2,2,2-trifluoroethylamino)methyl]phenyl]urea
CID 147104264
1-phenethyl-3-(1H-pyrazol-3-yl)urea
CID 482072
N-(tert-butyl)-3-(dimethylamino)-4-phenyl-1H-pyrazole-1-carboxamide
CID 1473149

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea?
The IUPAC name of 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea (CID 110469840) is 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea.
What is the SMILES notation for 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea?
The canonical SMILES for 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea is O=C(Nc1ccn[nH]1)NC1(c2ccccc2)CCCC1.
What is the InChIKey of 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea?
The InChIKey is QEZIEUPLLRIBCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c20-14(17-13-8-11-16-19-13)18-15(9-4-5-10-15)12-6-2-1-3-7-12/h1-3,6-8,11H,4-5,9-10H2,(H3,16,17,18,19,20).
What are the key properties of 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea?
1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea has a molecular weight of 270.34 g/mol, XLogP of 3.00, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylcyclopentyl)-3-(1H-pyrazol-5-yl)urea is sourced from PubChem (CID 110469840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).