N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine

C10H17N3 — CID 106580369

IUPACN-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine
SMILESCCC1(Nc2ncc(C)[nH]2)CCC1
InChIInChI=1S/C10H17N3/c1-3-10(5-4-6-10)13-9-11-7-8(2)12-9/h7H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyQQLCKSNPEWVRCH-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.46
Rot. Bonds3

About N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine

N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine (PubChem CID 106580369) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine
PubChem CID106580369
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine
SMILESCCC1(Nc2ncc(C)[nH]2)CCC1
InChIInChI=1S/C10H17N3/c1-3-10(5-4-6-10)13-9-11-7-8(2)12-9/h7H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyQQLCKSNPEWVRCH-UHFFFAOYSA-N
XLogP2.46
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
The IUPAC name of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine (CID 106580369) is N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine.
What is the SMILES notation for N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
The canonical SMILES for N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine is CCC1(Nc2ncc(C)[nH]2)CCC1.
What is the InChIKey of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
The InChIKey is QQLCKSNPEWVRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-3-10(5-4-6-10)13-9-11-7-8(2)12-9/h7H,3-6H2,1-2H3,(H2,11,12,13).
What are the key properties of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine has a molecular weight of 179.27 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine is sourced from PubChem (CID 106580369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).