1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea

C17H24N2O — CID 115573941

IUPAC1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea
SMILESO=C(NC1CCCCC1)NC1CCc2ccccc2C1
InChIInChI=1S/C17H24N2O/c20-17(18-15-8-2-1-3-9-15)19-16-11-10-13-6-4-5-7-14(13)12-16/h4-7,15-16H,1-3,8-12H2,(H2,18,19,20)
InChIKeyQDPCZNASHAAIBJ-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.18
Rot. Bonds2

About 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea

1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea (PubChem CID 115573941) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea.

Molecular Properties

Compound Name1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea
PubChem CID115573941
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea
SMILESO=C(NC1CCCCC1)NC1CCc2ccccc2C1
InChIInChI=1S/C17H24N2O/c20-17(18-15-8-2-1-3-9-15)19-16-11-10-13-6-4-5-7-14(13)12-16/h4-7,15-16H,1-3,8-12H2,(H2,18,19,20)
InChIKeyQDPCZNASHAAIBJ-UHFFFAOYSA-N
XLogP3.18
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4P-Pdot
CID 3976006
N-Cyclohexyl-N'-(Propyl)Phenyl Urea
CID 4358
N,N'-Bis(2-phenylethyl)urea
CID 95244
1-Cyclohexyl-3-(2-phenylethyl)urea
CID 742677
Butanamide, N-(1,2,3,4-tetrahydro-2-naphthalenyl)-
CID 10353304
N-(4beta-Phenyl-1,2,3,4-tetrahydronaphthalene-2beta-yl)propanamide
CID 24750357
Urea, (2-cyclohexyl-2-phenylethyl)-
CID 6472454
1-Cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
CID 4079580
4-P-Pdot
CID 6604798
N-(2-phenylethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 435861
N-Acetyl-2-aminotetralin
CID 10058319
N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 10442880

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea?
The IUPAC name of 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea (CID 115573941) is 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea.
What is the SMILES notation for 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea?
The canonical SMILES for 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea is O=C(NC1CCCCC1)NC1CCc2ccccc2C1.
What is the InChIKey of 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea?
The InChIKey is QDPCZNASHAAIBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c20-17(18-15-8-2-1-3-9-15)19-16-11-10-13-6-4-5-7-14(13)12-16/h4-7,15-16H,1-3,8-12H2,(H2,18,19,20).
What are the key properties of 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea?
1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea has a molecular weight of 272.39 g/mol, XLogP of 3.18, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea is sourced from PubChem (CID 115573941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).