1-(cyclohexylidenemethyl)-3-propylurea

C11H20N2O — CID 108912374

IUPAC1-(cyclohexylidenemethyl)-3-propylurea
SMILESCCCNC(=O)NC=C1CCCCC1
InChIInChI=1S/C11H20N2O/c1-2-8-12-11(14)13-9-10-6-4-3-5-7-10/h9H,2-8H2,1H3,(H2,12,13,14)
InChIKeyNQRNUDRAVYCFPA-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.54
Rot. Bonds3

About 1-(cyclohexylidenemethyl)-3-propylurea

1-(cyclohexylidenemethyl)-3-propylurea (PubChem CID 108912374) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-(cyclohexylidenemethyl)-3-propylurea.

Molecular Properties

Compound Name1-(cyclohexylidenemethyl)-3-propylurea
PubChem CID108912374
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-(cyclohexylidenemethyl)-3-propylurea
SMILESCCCNC(=O)NC=C1CCCCC1
InChIInChI=1S/C11H20N2O/c1-2-8-12-11(14)13-9-10-6-4-3-5-7-10/h9H,2-8H2,1H3,(H2,12,13,14)
InChIKeyNQRNUDRAVYCFPA-UHFFFAOYSA-N
XLogP2.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(cyclopentylidenemethyl)-3-[2-(dimethylamino)ethyl]urea
CID 108913658
1-(cyclopentylidenemethyl)-3-(5-hydroxypentyl)urea
CID 108913619
1-[2-(4-bromophenyl)ethyl]-3-(cyclohexylidenemethyl)urea
CID 108912711
1-[2-(4-chlorophenyl)ethyl]-3-(cyclohexylidenemethyl)urea
CID 108912710
1-(cyclopentylidenemethyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 108913488
N-(cyclobutylidenemethyl)propan-1-amine
CID 142065368
1-(cyclopentylidenemethyl)-3-[(2-methoxyphenyl)methyl]urea
CID 108913694
ethyl 4-(cyclohexylidenemethylcarbamoylamino)piperidine-1-carboxylate
CID 108912633
2-[4-(cyclohexylidenemethylcarbamoylamino)phenyl]acetic acid
CID 108912522
1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-propylurea
CID 110774865
1-(4-bromophenyl)-3-(cyclohexylidenemethyl)urea
CID 108912362
1-(cyclohexylidenemethyl)-3-(3,5-dichlorophenyl)urea
CID 108912618

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylidenemethyl)-3-propylurea?
The IUPAC name of 1-(cyclohexylidenemethyl)-3-propylurea (CID 108912374) is 1-(cyclohexylidenemethyl)-3-propylurea.
What is the SMILES notation for 1-(cyclohexylidenemethyl)-3-propylurea?
The canonical SMILES for 1-(cyclohexylidenemethyl)-3-propylurea is CCCNC(=O)NC=C1CCCCC1.
What is the InChIKey of 1-(cyclohexylidenemethyl)-3-propylurea?
The InChIKey is NQRNUDRAVYCFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-2-8-12-11(14)13-9-10-6-4-3-5-7-10/h9H,2-8H2,1H3,(H2,12,13,14).
What are the key properties of 1-(cyclohexylidenemethyl)-3-propylurea?
1-(cyclohexylidenemethyl)-3-propylurea has a molecular weight of 196.29 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylidenemethyl)-3-propylurea is sourced from PubChem (CID 108912374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).