N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine

C9H15N3 — CID 106581421

IUPACN-methyl-1-(3-methylcyclobutyl)imidazol-2-amine
SMILESCNc1nccn1C1CC(C)C1
InChIInChI=1S/C9H15N3/c1-7-5-8(6-7)12-4-3-11-9(12)10-2/h3-4,7-8H,5-6H2,1-2H3,(H,10,11)
InChIKeySJFGTWWOOSYGPT-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.90
Rot. Bonds2

About N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine

N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine (PubChem CID 106581421) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine.

Molecular Properties

Compound NameN-methyl-1-(3-methylcyclobutyl)imidazol-2-amine
PubChem CID106581421
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC NameN-methyl-1-(3-methylcyclobutyl)imidazol-2-amine
SMILESCNc1nccn1C1CC(C)C1
InChIInChI=1S/C9H15N3/c1-7-5-8(6-7)12-4-3-11-9(12)10-2/h3-4,7-8H,5-6H2,1-2H3,(H,10,11)
InChIKeySJFGTWWOOSYGPT-UHFFFAOYSA-N
XLogP1.90
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Pentyl-1H-imidazole
CID 529334
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CID 2734161
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4-(1H-imidazol-1-yl)butan-1-amine
CID 4379480
4-(2-(2-Methyl-1H-imidazol-1-yl)ethyl)piperidine
CID 6484685
1-Butyl-3-methylimidazolium Iodide
CID 11448496
1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-amine
CID 4310329
3-(1H-imidazol-1-yl)piperidine
CID 50986280
1-(2-Ethylbutyl)-1H-imidazole
CID 44345907
1-(Butan-2-yl)-1H-imidazole
CID 12415615
1-Subsituted 1H-imidazole, 7
CID 20148470
1H-Imidazole-1-ethanamine, N,N,beta,beta-tetramethyl-
CID 3062754

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine?
The IUPAC name of N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine (CID 106581421) is N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine.
What is the SMILES notation for N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine?
The canonical SMILES for N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine is CNc1nccn1C1CC(C)C1.
What is the InChIKey of N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine?
The InChIKey is SJFGTWWOOSYGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-7-5-8(6-7)12-4-3-11-9(12)10-2/h3-4,7-8H,5-6H2,1-2H3,(H,10,11).
What are the key properties of N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine?
N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine has a molecular weight of 165.24 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylcyclobutyl)imidazol-2-amine is sourced from PubChem (CID 106581421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).