1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine

C9H15N3 — CID 105432835

IUPAC1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine
SMILESCc1cnc(CCC2(N)CC2)[nH]1
InChIInChI=1S/C9H15N3/c1-7-6-11-8(12-7)2-3-9(10)4-5-9/h6H,2-5,10H2,1H3,(H,11,12)
InChIKeyBYIFLDXPPNZXJF-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.14
Rot. Bonds3

About 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine

1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine (PubChem CID 105432835) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine
PubChem CID105432835
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine
SMILESCc1cnc(CCC2(N)CC2)[nH]1
InChIInChI=1S/C9H15N3/c1-7-6-11-8(12-7)2-3-9(10)4-5-9/h6H,2-5,10H2,1H3,(H,11,12)
InChIKeyBYIFLDXPPNZXJF-UHFFFAOYSA-N
XLogP1.14
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine (CID 105432835) is 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine is Cc1cnc(CCC2(N)CC2)[nH]1.
What is the InChIKey of 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine?
The InChIKey is BYIFLDXPPNZXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-7-6-11-8(12-7)2-3-9(10)4-5-9/h6H,2-5,10H2,1H3,(H,11,12).
What are the key properties of 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine?
1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine has a molecular weight of 165.24 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-methyl-1H-imidazol-2-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105432835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).