N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine

C10H21N3 — CID 174332882

IUPACN-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCCC(CC)CCNC1=NCCN1
InChIInChI=1S/C10H21N3/c1-3-9(4-2)5-6-11-10-12-7-8-13-10/h9H,3-8H2,1-2H3,(H2,11,12,13)
InChIKeyRBJZGPCPOHJUFP-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.36
Rot. Bonds5

About N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine

N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 174332882) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID174332882
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCCC(CC)CCNC1=NCCN1
InChIInChI=1S/C10H21N3/c1-3-9(4-2)5-6-11-10-12-7-8-13-10/h9H,3-8H2,1-2H3,(H2,11,12,13)
InChIKeyRBJZGPCPOHJUFP-UHFFFAOYSA-N
XLogP1.36
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine (CID 174332882) is N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine is CCC(CC)CCNC1=NCCN1.
What is the InChIKey of N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is RBJZGPCPOHJUFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-3-9(4-2)5-6-11-10-12-7-8-13-10/h9H,3-8H2,1-2H3,(H2,11,12,13).
What are the key properties of N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 183.30 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylpentyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 174332882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).