1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea

C19H24N2O2 — CID 4064420

IUPAC1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea
SMILESCC(c1ccco1)N(C(=O)Nc1ccccc1)C1CCCCC1
InChIInChI=1S/C19H24N2O2/c1-15(18-13-8-14-23-18)21(17-11-6-3-7-12-17)19(22)20-16-9-4-2-5-10-16/h2,4-5,8-10,13-15,17H,3,6-7,11-12H2,1H3,(H,20,22)
InChIKeyKBKCNTBOQJKCRY-UHFFFAOYSA-N
MW312.41 g/mol
LogP5.21
Rot. Bonds4

About 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea

1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea (PubChem CID 4064420) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea.

Molecular Properties

Compound Name1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea
PubChem CID4064420
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea
SMILESCC(c1ccco1)N(C(=O)Nc1ccccc1)C1CCCCC1
InChIInChI=1S/C19H24N2O2/c1-15(18-13-8-14-23-18)21(17-11-6-3-7-12-17)19(22)20-16-9-4-2-5-10-16/h2,4-5,8-10,13-15,17H,3,6-7,11-12H2,1H3,(H,20,22)
InChIKeyKBKCNTBOQJKCRY-UHFFFAOYSA-N
XLogP5.21
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.41
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[chloro(phenyl)methyl]-1-cyclopentyl-3-phenylurea
CID 150441182
2-cyclopentyl-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]acetamide
CID 60576605
1-cyclopropyl-3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[1-(furan-2-yl)ethyl]urea
CID 71972779
1-[1-(furan-2-yl)ethyl]-1-(furan-2-ylmethyl)-3-phenylurea
CID 3244728
3-[(1R)-cyclohex-3-en-1-yl]-1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]urea
CID 97048743
1-cyclohexyl-1-hydroxy-3-phenylurea
CID 86182203
3-[[cyclopropyl-[1-(furan-2-yl)ethyl]carbamoyl]amino]-N,2-dimethylbenzamide
CID 71922388
1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-[(3R)-hex-5-yn-3-yl]urea
CID 97048807
3-(4-chlorophenyl)-1-cyclopentyl-1-[(1S)-1-pyridin-2-ylethyl]urea
CID 159086975
1-cyclopropyl-1-[(1S)-1-(furan-2-yl)ethyl]-3-[(2R)-2-pyridin-4-ylpropyl]urea
CID 97222800
1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-2-ylmethyl)urea
CID 97048634
2-[cycloheptyl(methyl)amino]-N-phenylacetamide
CID 16577724

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea?
The IUPAC name of 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea (CID 4064420) is 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea.
What is the SMILES notation for 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea?
The canonical SMILES for 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea is CC(c1ccco1)N(C(=O)Nc1ccccc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea?
The InChIKey is KBKCNTBOQJKCRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15(18-13-8-14-23-18)21(17-11-6-3-7-12-17)19(22)20-16-9-4-2-5-10-16/h2,4-5,8-10,13-15,17H,3,6-7,11-12H2,1H3,(H,20,22).
What are the key properties of 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea?
1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea has a molecular weight of 312.41 g/mol, XLogP of 5.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-[1-(furan-2-yl)ethyl]-3-phenylurea is sourced from PubChem (CID 4064420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).