(2-methylcyclopropyl)methylurea

C6H12N2O — CID 115582645

IUPAC(2-methylcyclopropyl)methylurea
SMILESCC1CC1CNC(N)=O
InChIInChI=1S/C6H12N2O/c1-4-2-5(4)3-8-6(7)9/h4-5H,2-3H2,1H3,(H3,7,8,9)
InChIKeyHALUIUDLSQMONP-UHFFFAOYSA-N
MW128.18 g/mol
LogP0.31
Rot. Bonds2

About (2-methylcyclopropyl)methylurea

(2-methylcyclopropyl)methylurea (PubChem CID 115582645) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is (2-methylcyclopropyl)methylurea.

Molecular Properties

Compound Name(2-methylcyclopropyl)methylurea
PubChem CID115582645
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC Name(2-methylcyclopropyl)methylurea
SMILESCC1CC1CNC(N)=O
InChIInChI=1S/C6H12N2O/c1-4-2-5(4)3-8-6(7)9/h4-5H,2-3H2,1H3,(H3,7,8,9)
InChIKeyHALUIUDLSQMONP-UHFFFAOYSA-N
XLogP0.31
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(2-methylcyclopentyl)methylurea
CID 107417745
2-hydroxy-N-[(2-methylcyclopropyl)methyl]acetamide
CID 126990825
(3-methylcyclopentyl)methylurea
CID 20542807
3-methyl-N-[(2-methylcyclopropyl)methyl]but-2-enamide
CID 130157235
1-(aminomethyl)-N-[(2-methylcyclopropyl)methyl]cyclopentane-1-carboxamide
CID 115738374
2-(2-aminoethoxy)-N-[(2-methylcyclopropyl)methyl]acetamide
CID 115738383
2-amino-3-methyl-N-[(2-methylcyclopropyl)methyl]pentanamide
CID 115738399
N-[(2-methylcyclopropyl)methyl]-3-oxocyclobutane-1-carboxamide
CID 130650873
2-[(1S,2R)-2-methylcyclopropyl]acetamide
CID 93476800
(3-hydroxycyclobutyl)methylurea
CID 66005226
2-(4-aminophenyl)-N-[(2-methylcyclopropyl)methyl]acetamide
CID 115597585
2-methyl-2-[(2-methylcyclopropyl)methylcarbamoylamino]propanoic acid
CID 103995921

Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopropyl)methylurea?
The IUPAC name of (2-methylcyclopropyl)methylurea (CID 115582645) is (2-methylcyclopropyl)methylurea.
What is the SMILES notation for (2-methylcyclopropyl)methylurea?
The canonical SMILES for (2-methylcyclopropyl)methylurea is CC1CC1CNC(N)=O.
What is the InChIKey of (2-methylcyclopropyl)methylurea?
The InChIKey is HALUIUDLSQMONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-4-2-5(4)3-8-6(7)9/h4-5H,2-3H2,1H3,(H3,7,8,9).
What are the key properties of (2-methylcyclopropyl)methylurea?
(2-methylcyclopropyl)methylurea has a molecular weight of 128.18 g/mol, XLogP of 0.31, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopropyl)methylurea is sourced from PubChem (CID 115582645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).