(3-methylcyclopentyl)methylurea

C8H16N2O — CID 20542807

IUPAC(3-methylcyclopentyl)methylurea
SMILESCC1CCC(CNC(N)=O)C1
InChIInChI=1S/C8H16N2O/c1-6-2-3-7(4-6)5-10-8(9)11/h6-7H,2-5H2,1H3,(H3,9,10,11)
InChIKeyXACKWDHNRYGKEO-UHFFFAOYSA-N
MW156.23 g/mol
LogP1.09
Rot. Bonds2

About (3-methylcyclopentyl)methylurea

(3-methylcyclopentyl)methylurea (PubChem CID 20542807) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (3-methylcyclopentyl)methylurea.

Molecular Properties

Compound Name(3-methylcyclopentyl)methylurea
PubChem CID20542807
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(3-methylcyclopentyl)methylurea
SMILESCC1CCC(CNC(N)=O)C1
InChIInChI=1S/C8H16N2O/c1-6-2-3-7(4-6)5-10-8(9)11/h6-7H,2-5H2,1H3,(H3,9,10,11)
InChIKeyXACKWDHNRYGKEO-UHFFFAOYSA-N
XLogP1.09
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze (3-methylcyclopentyl)methylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-2-methyl-N-[(3-methylcyclopentyl)methyl]propanamide
CID 107413148
N-[(3-methylcyclopentyl)methyl]butanamide
CID 107415486
2-bromo-N-[(3-methylcyclopentyl)methyl]acetamide
CID 107412345
N-(2-aminoethyl)-N'-[(3-methylcyclopentyl)methyl]oxamide
CID 107411052
2,2,2-trifluoro-N-[(3-methylcyclopentyl)methyl]acetamide
CID 107415477
3-[(3-methylcyclopentyl)methylamino]propanamide
CID 107412716
3-amino-3-methyl-N-[(3-methylcyclopentyl)methyl]butanamide
CID 107413266
3-amino-3-hydroxyimino-2,2-dimethyl-N-[(3-methylcyclopentyl)methyl]propanamide
CID 107414834
2-[(3-methylcyclopentyl)methylcarbamoylamino]oxyacetic acid
CID 107414533
propan-2-yl N-[(3-methylcyclopentyl)methyl]carbamate
CID 107412401
2-[(3-methylcyclopentyl)methylamino]acetic acid
CID 107412592
1-(aminomethyl)-N-[(3-methylcyclopentyl)methyl]cycloheptane-1-carboxamide
CID 107412357

Frequently Asked Questions

What is the IUPAC name of (3-methylcyclopentyl)methylurea?
The IUPAC name of (3-methylcyclopentyl)methylurea (CID 20542807) is (3-methylcyclopentyl)methylurea.
What is the SMILES notation for (3-methylcyclopentyl)methylurea?
The canonical SMILES for (3-methylcyclopentyl)methylurea is CC1CCC(CNC(N)=O)C1.
What is the InChIKey of (3-methylcyclopentyl)methylurea?
The InChIKey is XACKWDHNRYGKEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6-2-3-7(4-6)5-10-8(9)11/h6-7H,2-5H2,1H3,(H3,9,10,11).
What are the key properties of (3-methylcyclopentyl)methylurea?
(3-methylcyclopentyl)methylurea has a molecular weight of 156.23 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylcyclopentyl)methylurea is sourced from PubChem (CID 20542807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).