1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea

C10H18N2O — CID 130718605

IUPAC1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea
SMILESCC1CC(NC(=O)N(C)C2CC2)C1
InChIInChI=1S/C10H18N2O/c1-7-5-8(6-7)11-10(13)12(2)9-3-4-9/h7-9H,3-6H2,1-2H3,(H,11,13)
InChIKeyPHFXZBQXWHOTAL-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.59
Rot. Bonds2

About 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea

1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea (PubChem CID 130718605) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea
PubChem CID130718605
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea
SMILESCC1CC(NC(=O)N(C)C2CC2)C1
InChIInChI=1S/C10H18N2O/c1-7-5-8(6-7)11-10(13)12(2)9-3-4-9/h7-9H,3-6H2,1-2H3,(H,11,13)
InChIKeyPHFXZBQXWHOTAL-UHFFFAOYSA-N
XLogP1.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cis-(1R,3S)-3-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 106319286
1-cyclopropyl-1-methyl-3-(oxolan-3-yl)urea
CID 115760744
1-(4-aminocyclohexyl)-3-cyclohexyl-1-methylurea
CID 79121066
3-[[methyl-(3-methylcyclohexyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 63043737
4-[(3,5-dimethylcyclohexyl)carbamoyl-methylamino]oxolane-3-carboxylic acid
CID 66265351
3-(1-acetylpiperidin-4-yl)-1-cyclohexyl-1-methylurea
CID 47240964
2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 64815725
3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 63042287
1-(4-cyanocyclohexyl)-3-cyclohexyl-1-methylurea
CID 115270228
1-cyclobutyl-1-methyl-3-(oxolan-3-yl)urea
CID 115760727
4-[[cycloheptyl(methyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 61201100
3-cyclohexyl-1-methyl-1-(4-oxocyclohexyl)urea
CID 79120718

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea?
The IUPAC name of 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea (CID 130718605) is 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea.
What is the SMILES notation for 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea?
The canonical SMILES for 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea is CC1CC(NC(=O)N(C)C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea?
The InChIKey is PHFXZBQXWHOTAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7-5-8(6-7)11-10(13)12(2)9-3-4-9/h7-9H,3-6H2,1-2H3,(H,11,13).
What are the key properties of 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea?
1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea has a molecular weight of 182.27 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-methyl-3-(3-methylcyclobutyl)urea is sourced from PubChem (CID 130718605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).