cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine

C8H13N3 — CID 130118459

IUPACcyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine
SMILESCc1cnc(C(N)C2CC2)[nH]1
InChIInChI=1S/C8H13N3/c1-5-4-10-8(11-5)7(9)6-2-3-6/h4,6-7H,2-3,9H2,1H3,(H,10,11)
InChIKeyOHBMBOVXGHXUAW-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.13
Rot. Bonds2

About cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine

cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine (PubChem CID 130118459) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine.

Molecular Properties

Compound Namecyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine
PubChem CID130118459
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Namecyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine
SMILESCc1cnc(C(N)C2CC2)[nH]1
InChIInChI=1S/C8H13N3/c1-5-4-10-8(11-5)7(9)6-2-3-6/h4,6-7H,2-3,9H2,1H3,(H,10,11)
InChIKeyOHBMBOVXGHXUAW-UHFFFAOYSA-N
XLogP1.13
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine?
The IUPAC name of cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine (CID 130118459) is cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine.
What is the SMILES notation for cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine?
The canonical SMILES for cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine is Cc1cnc(C(N)C2CC2)[nH]1.
What is the InChIKey of cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine?
The InChIKey is OHBMBOVXGHXUAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-5-4-10-8(11-5)7(9)6-2-3-6/h4,6-7H,2-3,9H2,1H3,(H,10,11).
What are the key properties of cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine?
cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine has a molecular weight of 151.21 g/mol, XLogP of 1.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(5-methyl-1H-imidazol-2-yl)methanamine is sourced from PubChem (CID 130118459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).