1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea

C19H24N2O — CID 108888599

IUPAC1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea
SMILESO=C(NCCC1CCCCC1)Nc1cccc2ccccc12
InChIInChI=1S/C19H24N2O/c22-19(20-14-13-15-7-2-1-3-8-15)21-18-12-6-10-16-9-4-5-11-17(16)18/h4-6,9-12,15H,1-3,7-8,13-14H2,(H2,20,21,22)
InChIKeyYFVDDHAGAOBTQT-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.93
Rot. Bonds4

About 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea

1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea (PubChem CID 108888599) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea.

Molecular Properties

Compound Name1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea
PubChem CID108888599
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea
SMILESO=C(NCCC1CCCCC1)Nc1cccc2ccccc12
InChIInChI=1S/C19H24N2O/c22-19(20-14-13-15-7-2-1-3-8-15)21-18-12-6-10-16-9-4-5-11-17(16)18/h4-6,9-12,15H,1-3,7-8,13-14H2,(H2,20,21,22)
InChIKeyYFVDDHAGAOBTQT-UHFFFAOYSA-N
XLogP4.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-cyclohexylethyl)-3-(2-hydroxyphenyl)urea
CID 108888519
1-(2-cyclohexylethyl)-3-(2,3-dichlorophenyl)urea
CID 108888463
3-cyclohexyl-N-[5-(3-cyclohexylpropanoylamino)naphthalen-1-yl]propanamide
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1-naphthalen-1-yl-3-(3-oxobutyl)urea
CID 108895153
1-(2-cyclohexylethyl)-3-(2-morpholin-4-ylphenyl)urea
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1-(3-amino-3-sulfanylidenepropyl)-3-naphthalen-1-ylurea
CID 62667648
1-[2-(aziridin-1-yl)ethyl]-3-naphthalen-1-ylurea
CID 598105
1-naphthalen-1-yl-3-[2-(propan-2-ylamino)ethyl]urea
CID 62664928
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
N-(2-cyclopentylethyl)-1-hydroxynaphthalene-2-carboxamide
CID 63524506
1-[2-[(R)-methylsulfinyl]ethyl]-3-naphthalen-1-ylurea
CID 51686352

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea?
The IUPAC name of 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea (CID 108888599) is 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea.
What is the SMILES notation for 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea?
The canonical SMILES for 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea is O=C(NCCC1CCCCC1)Nc1cccc2ccccc12.
What is the InChIKey of 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea?
The InChIKey is YFVDDHAGAOBTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c22-19(20-14-13-15-7-2-1-3-8-15)21-18-12-6-10-16-9-4-5-11-17(16)18/h4-6,9-12,15H,1-3,7-8,13-14H2,(H2,20,21,22).
What are the key properties of 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea?
1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea has a molecular weight of 296.41 g/mol, XLogP of 4.93, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylethyl)-3-naphthalen-1-ylurea is sourced from PubChem (CID 108888599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).