N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine

C9H15N3 — CID 130906329

IUPACN-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine
SMILESCN(CC1CCC1)c1ncc[nH]1
InChIInChI=1S/C9H15N3/c1-12(7-8-3-2-4-8)9-10-5-6-11-9/h5-6,8H,2-4,7H2,1H3,(H,10,11)
InChIKeyGOMFTQRDPBRTMF-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.65
Rot. Bonds3

About N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine

N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine (PubChem CID 130906329) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine
PubChem CID130906329
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC NameN-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine
SMILESCN(CC1CCC1)c1ncc[nH]1
InChIInChI=1S/C9H15N3/c1-12(7-8-3-2-4-8)9-10-5-6-11-9/h5-6,8H,2-4,7H2,1H3,(H,10,11)
InChIKeyGOMFTQRDPBRTMF-UHFFFAOYSA-N
XLogP1.65
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine?
The IUPAC name of N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine (CID 130906329) is N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine?
The canonical SMILES for N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine is CN(CC1CCC1)c1ncc[nH]1.
What is the InChIKey of N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine?
The InChIKey is GOMFTQRDPBRTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-12(7-8-3-2-4-8)9-10-5-6-11-9/h5-6,8H,2-4,7H2,1H3,(H,10,11).
What are the key properties of N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine?
N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine has a molecular weight of 165.24 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-methyl-1H-imidazol-2-amine is sourced from PubChem (CID 130906329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).