(2-methylcyclopentyl)methylurea

C8H16N2O — CID 107417745

IUPAC(2-methylcyclopentyl)methylurea
SMILESCC1CCCC1CNC(N)=O
InChIInChI=1S/C8H16N2O/c1-6-3-2-4-7(6)5-10-8(9)11/h6-7H,2-5H2,1H3,(H3,9,10,11)
InChIKeySTDAVSCFYLCDDS-UHFFFAOYSA-N
MW156.23 g/mol
LogP1.09
Rot. Bonds2

About (2-methylcyclopentyl)methylurea

(2-methylcyclopentyl)methylurea (PubChem CID 107417745) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (2-methylcyclopentyl)methylurea.

Molecular Properties

Compound Name(2-methylcyclopentyl)methylurea
PubChem CID107417745
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(2-methylcyclopentyl)methylurea
SMILESCC1CCCC1CNC(N)=O
InChIInChI=1S/C8H16N2O/c1-6-3-2-4-7(6)5-10-8(9)11/h6-7H,2-5H2,1H3,(H3,9,10,11)
InChIKeySTDAVSCFYLCDDS-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

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Related Compounds

(2S)-2-amino-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107418588
(2-methylcyclopropyl)methylurea
CID 115582645
3-amino-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107417700
N-(2-aminoethyl)-N'-[(2-methylcyclopentyl)methyl]oxamide
CID 107416399
N-[(2-methylcyclopentyl)methyl]butanamide
CID 107420814
2-[(2-methylcyclopentyl)methylamino]acetamide
CID 107418039
2-[(2-methylcyclopentyl)methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 107416685
1-tert-butyl-3-[(2-methylcyclopentyl)methyl]urea
CID 107417748
3-bromo-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107417690
4-amino-N-[(2-methylcyclopentyl)methyl]pentanamide
CID 107418378
1-carbamothioyl-N-[(2-methylcyclopentyl)methyl]cyclobutane-1-carboxamide
CID 107418708
3-chloro-2,2-dimethyl-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107417691

Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopentyl)methylurea?
The IUPAC name of (2-methylcyclopentyl)methylurea (CID 107417745) is (2-methylcyclopentyl)methylurea.
What is the SMILES notation for (2-methylcyclopentyl)methylurea?
The canonical SMILES for (2-methylcyclopentyl)methylurea is CC1CCCC1CNC(N)=O.
What is the InChIKey of (2-methylcyclopentyl)methylurea?
The InChIKey is STDAVSCFYLCDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6-3-2-4-7(6)5-10-8(9)11/h6-7H,2-5H2,1H3,(H3,9,10,11).
What are the key properties of (2-methylcyclopentyl)methylurea?
(2-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 (2-methylcyclopentyl)methylurea is sourced from PubChem (CID 107417745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).