N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine

C10H17N3 — CID 131155864

IUPACN-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine
SMILESCC1(C)CCC(Nc2cnc[nH]2)C1
InChIInChI=1S/C10H17N3/c1-10(2)4-3-8(5-10)13-9-6-11-7-12-9/h6-8,13H,3-5H2,1-2H3,(H,11,12)
InChIKeyLKOKDOJNQPZWNH-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.40
Rot. Bonds2

About N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine

N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine (PubChem CID 131155864) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine.

Molecular Properties

Compound NameN-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine
PubChem CID131155864
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine
SMILESCC1(C)CCC(Nc2cnc[nH]2)C1
InChIInChI=1S/C10H17N3/c1-10(2)4-3-8(5-10)13-9-6-11-7-12-9/h6-8,13H,3-5H2,1-2H3,(H,11,12)
InChIKeyLKOKDOJNQPZWNH-UHFFFAOYSA-N
XLogP2.40
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine?
The IUPAC name of N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine (CID 131155864) is N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine.
What is the SMILES notation for N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine?
The canonical SMILES for N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine is CC1(C)CCC(Nc2cnc[nH]2)C1.
What is the InChIKey of N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine?
The InChIKey is LKOKDOJNQPZWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-10(2)4-3-8(5-10)13-9-6-11-7-12-9/h6-8,13H,3-5H2,1-2H3,(H,11,12).
What are the key properties of N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine?
N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine has a molecular weight of 179.27 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclopentyl)-1H-imidazol-5-amine is sourced from PubChem (CID 131155864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).