2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine

C10H21N3 — CID 174534223

IUPAC2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine
SMILESCCCCCN1CC(N)N=C1CC
InChIInChI=1S/C10H21N3/c1-3-5-6-7-13-8-9(11)12-10(13)4-2/h9H,3-8,11H2,1-2H3
InChIKeyNICANJVZSFSRJJ-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.59
Rot. Bonds5

About 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine

2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine (PubChem CID 174534223) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine.

Molecular Properties

Compound Name2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine
PubChem CID174534223
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine
SMILESCCCCCN1CC(N)N=C1CC
InChIInChI=1S/C10H21N3/c1-3-5-6-7-13-8-9(11)12-10(13)4-2/h9H,3-8,11H2,1-2H3
InChIKeyNICANJVZSFSRJJ-UHFFFAOYSA-N
XLogP1.59
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-amino-1-pentylpiperidin-2-one
CID 64977965
1-butyl-4-methyl-4,5-dihydroimidazol-2-amine
CID 45088430
5-amino-1-dodecylpiperidin-2-one
CID 64977984
1-butyl-2,4-dimethyl-4,5-dihydroimidazole
CID 71402158
1-decyl-4,5-dihydroimidazol-2-amine
CID 154199553
1-pentyl-2-undecyl-4,5-dihydroimidazole
CID 67928425
4-chloro-1-hexylpyrrolidin-2-one
CID 168687403
5-(aminomethyl)-3-heptyl-1,3-oxazolidin-2-one
CID 112594228
5-(aminomethyl)-3-dodecyl-1,3-oxazolidin-2-one
CID 115944261
5-oxo-1-pentylpyrrolidine-3-sulfonyl chloride
CID 168711163
1,3-dioctylimidazolidin-2-one
CID 19987667
5-amino-1-butylpiperidin-2-one
CID 64978058

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine?
The IUPAC name of 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine (CID 174534223) is 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine.
What is the SMILES notation for 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine?
The canonical SMILES for 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine is CCCCCN1CC(N)N=C1CC.
What is the InChIKey of 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine?
The InChIKey is NICANJVZSFSRJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-3-5-6-7-13-8-9(11)12-10(13)4-2/h9H,3-8,11H2,1-2H3.
What are the key properties of 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine?
2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine has a molecular weight of 183.30 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-pentyl-4,5-dihydroimidazol-4-amine is sourced from PubChem (CID 174534223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).