1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea

C10H16N4O — CID 47198802

IUPAC1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea
SMILESCC(C)n1nccc1NC(=O)NC1CC1
InChIInChI=1S/C10H16N4O/c1-7(2)14-9(5-6-11-14)13-10(15)12-8-3-4-8/h5-8H,3-4H2,1-2H3,(H2,12,13,15)
InChIKeyLXNCLYMSKOQVNZ-UHFFFAOYSA-N
MW208.27 g/mol
LogP1.75
Rot. Bonds3

About 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea

1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea (PubChem CID 47198802) has the molecular formula C10H16N4O and a molecular weight of 208.27 g/mol. Its IUPAC name is 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea
PubChem CID47198802
Molecular FormulaC10H16N4O
Molecular Weight208.27 g/mol
Exact Mass208.13
IUPAC Name1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea
SMILESCC(C)n1nccc1NC(=O)NC1CC1
InChIInChI=1S/C10H16N4O/c1-7(2)14-9(5-6-11-14)13-10(15)12-8-3-4-8/h5-8H,3-4H2,1-2H3,(H2,12,13,15)
InChIKeyLXNCLYMSKOQVNZ-UHFFFAOYSA-N
XLogP1.75
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-3-(2-propan-2-ylpyrazol-3-yl)urea
CID 47103204
2-(cyclopropylamino)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 60687383
1-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-3-(1-propylpiperidin-4-yl)urea
CID 97248271
1-[(2S,3R)-2-(4-chlorophenyl)oxolan-3-yl]-3-(2-propan-2-ylpyrazol-3-yl)urea
CID 97122784
methyl N-(2-propan-2-ylpyrazol-3-yl)carbamate
CID 115619372
N-(2-propan-2-ylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
CID 119268271
2-(azepan-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 42913354
2-amino-N-(2-propan-2-ylpyrazol-3-yl)cyclopentane-1-carboxamide
CID 64817560
3-amino-N-(2-propan-2-ylpyrazol-3-yl)cyclopentane-1-carboxamide
CID 66031864
1-[2-[(1R)-1-cyclopropylethyl]pyrazol-3-yl]-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]urea
CID 124619687
1-[2-[(2R)-pentan-2-yl]pyrazol-3-yl]-3-(1-pyrazin-2-ylpiperidin-4-yl)urea
CID 125163687
N-(2-propan-2-ylpyrazol-3-yl)morpholine-4-carboxamide
CID 47198657

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea?
The IUPAC name of 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea (CID 47198802) is 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea?
The canonical SMILES for 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea is CC(C)n1nccc1NC(=O)NC1CC1.
What is the InChIKey of 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea?
The InChIKey is LXNCLYMSKOQVNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7(2)14-9(5-6-11-14)13-10(15)12-8-3-4-8/h5-8H,3-4H2,1-2H3,(H2,12,13,15).
What are the key properties of 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea?
1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea has a molecular weight of 208.27 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(2-propan-2-ylpyrazol-3-yl)urea is sourced from PubChem (CID 47198802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).