1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea

C10H20N2O — CID 131113753

IUPAC1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea
SMILESCC(C)NC(=O)NC1CC(C)C1C
InChIInChI=1S/C10H20N2O/c1-6(2)11-10(13)12-9-5-7(3)8(9)4/h6-9H,5H2,1-4H3,(H2,11,12,13)
InChIKeyQUHANXHPVPDZDD-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.74
Rot. Bonds2

About 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea

1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea (PubChem CID 131113753) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea.

Molecular Properties

Compound Name1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea
PubChem CID131113753
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea
SMILESCC(C)NC(=O)NC1CC(C)C1C
InChIInChI=1S/C10H20N2O/c1-6(2)11-10(13)12-9-5-7(3)8(9)4/h6-9H,5H2,1-4H3,(H2,11,12,13)
InChIKeyQUHANXHPVPDZDD-UHFFFAOYSA-N
XLogP1.74
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-amino-3-(2,3-dimethylcyclobutyl)urea
CID 127009267
1-(2-methylcycloheptyl)-3-propan-2-ylurea
CID 115660988
2-chloro-N-[(2,3-dimethylcyclobutyl)carbamoyl]acetamide
CID 130892509
(2S)-2-amino-N-(2,3-dimethylcyclobutyl)-3-methylbutanamide
CID 130965044
1-(2-fluoro-2-methylcyclopropyl)-3-propan-2-ylurea
CID 118330200
1-(2-methylpiperidin-4-yl)-3-propan-2-ylurea
CID 106995611
1-amino-3-(2-methylcyclopropyl)urea
CID 62408837
N-(2,3-dimethylcyclobutyl)azetidine-3-carboxamide
CID 130847724
(2R)-2-[(2,3-dimethylcyclobutyl)amino]-N-methylpropanamide
CID 131154093
2-chloro-N-[(2-methylcyclopropyl)carbamoyl]propanamide
CID 62410358
1-(4-methoxypyrrolidin-3-yl)-3-propan-2-ylurea
CID 74884463
1-[(2S)-butan-2-yl]-3-[(1R,2R)-2-methylcyclohexyl]urea
CID 124715194

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea?
The IUPAC name of 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea (CID 131113753) is 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea.
What is the SMILES notation for 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea?
The canonical SMILES for 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea is CC(C)NC(=O)NC1CC(C)C1C.
What is the InChIKey of 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea?
The InChIKey is QUHANXHPVPDZDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-6(2)11-10(13)12-9-5-7(3)8(9)4/h6-9H,5H2,1-4H3,(H2,11,12,13).
What are the key properties of 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea?
1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea has a molecular weight of 184.28 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylcyclobutyl)-3-propan-2-ylurea is sourced from PubChem (CID 131113753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).