N-(cyclopentylmethyl)-1H-imidazol-5-amine

C9H15N3 — CID 131176370

IUPACN-(cyclopentylmethyl)-1H-imidazol-5-amine
SMILESc1ncc(NCC2CCCC2)[nH]1
InChIInChI=1S/C9H15N3/c1-2-4-8(3-1)5-11-9-6-10-7-12-9/h6-8,11H,1-5H2,(H,10,12)
InChIKeyHIVCNQWNOFJUNY-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.01
Rot. Bonds3

About N-(cyclopentylmethyl)-1H-imidazol-5-amine

N-(cyclopentylmethyl)-1H-imidazol-5-amine (PubChem CID 131176370) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-1H-imidazol-5-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-1H-imidazol-5-amine
PubChem CID131176370
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC NameN-(cyclopentylmethyl)-1H-imidazol-5-amine
SMILESc1ncc(NCC2CCCC2)[nH]1
InChIInChI=1S/C9H15N3/c1-2-4-8(3-1)5-11-9-6-10-7-12-9/h6-8,11H,1-5H2,(H,10,12)
InChIKeyHIVCNQWNOFJUNY-UHFFFAOYSA-N
XLogP2.01
TPSA40.71 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 ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-1H-imidazol-5-amine?
The IUPAC name of N-(cyclopentylmethyl)-1H-imidazol-5-amine (CID 131176370) is N-(cyclopentylmethyl)-1H-imidazol-5-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-1H-imidazol-5-amine?
The canonical SMILES for N-(cyclopentylmethyl)-1H-imidazol-5-amine is c1ncc(NCC2CCCC2)[nH]1.
What is the InChIKey of N-(cyclopentylmethyl)-1H-imidazol-5-amine?
The InChIKey is HIVCNQWNOFJUNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-4-8(3-1)5-11-9-6-10-7-12-9/h6-8,11H,1-5H2,(H,10,12).
What are the key properties of N-(cyclopentylmethyl)-1H-imidazol-5-amine?
N-(cyclopentylmethyl)-1H-imidazol-5-amine has a molecular weight of 165.24 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-1H-imidazol-5-amine is sourced from PubChem (CID 131176370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).