1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea

C15H25N3O2 — CID 53016542

IUPAC1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea
SMILESO=C(NC1CCCCC1)NC1CCN(C(=O)C2CC2)C1
InChIInChI=1S/C15H25N3O2/c19-14(11-6-7-11)18-9-8-13(10-18)17-15(20)16-12-4-2-1-3-5-12/h11-13H,1-10H2,(H2,16,17,20)
InChIKeyKJWULUNMAISCJZ-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.63
Rot. Bonds3

About 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea

1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea (PubChem CID 53016542) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea.

Molecular Properties

Compound Name1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea
PubChem CID53016542
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea
SMILESO=C(NC1CCCCC1)NC1CCN(C(=O)C2CC2)C1
InChIInChI=1S/C15H25N3O2/c19-14(11-6-7-11)18-9-8-13(10-18)17-15(20)16-12-4-2-1-3-5-12/h11-13H,1-10H2,(H2,16,17,20)
InChIKeyKJWULUNMAISCJZ-UHFFFAOYSA-N
XLogP1.63
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclohexyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl)cyclopropanecarboxamide
CID 2969407
N1-cyclohexyl-N2-cyclopropylpyrrolidine-1,2-dicarboxamide
CID 3221230
1-N-cyclohexyl-2-N-(3-methylbutyl)pyrrolidine-1,2-dicarboxamide
CID 3219609
1-Cyclohexyl-3-[3-(2-oxo-pyrrolidin-1-yl)-propyl]-urea
CID 3226716
3-Cyclohexyl-5-isopropylimidazolidine-2,4-dione
CID 5273849
1-(1-Cyclopropanecarbonylpyrrolidin-3-YL)-3-ethylurea
CID 53016474
3-Tert-butyl-1-(1-cyclopropanecarbonylpyrrolidin-3-YL)urea
CID 53016518
1-Cyclopentyl-3-(1-cyclopropanecarbonylpyrrolidin-3-YL)urea
CID 53016534
3-(1-Cyclobutanecarbonylpyrrolidin-3-YL)-1-cyclohexylurea
CID 53016543
(3S)-1-N-cyclohexyl-3-N-methylpyrrolidine-1,3-dicarboxamide
CID 164634114
1-(cyclobutylmethyl)-1-(cyclopropylmethyl)-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea
CID 164640949
N-[(4S)-1-cyclohexyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]cyclopropanecarboxamide
CID 2025455

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea?
The IUPAC name of 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea (CID 53016542) is 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea.
What is the SMILES notation for 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea?
The canonical SMILES for 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea is O=C(NC1CCCCC1)NC1CCN(C(=O)C2CC2)C1.
What is the InChIKey of 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea?
The InChIKey is KJWULUNMAISCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c19-14(11-6-7-11)18-9-8-13(10-18)17-15(20)16-12-4-2-1-3-5-12/h11-13H,1-10H2,(H2,16,17,20).
What are the key properties of 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea?
1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea has a molecular weight of 279.38 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]urea is sourced from PubChem (CID 53016542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).