5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine

C8H17N3 — CID 79510805

IUPAC5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine
SMILESCCCC(C)C1CN=C(N)N1
InChIInChI=1S/C8H17N3/c1-3-4-6(2)7-5-10-8(9)11-7/h6-7H,3-5H2,1-2H3,(H3,9,10,11)
InChIKeyGVYJUHQCYNYLHH-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.71
Rot. Bonds3

About 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine

5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 79510805) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine
PubChem CID79510805
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC Name5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine
SMILESCCCC(C)C1CN=C(N)N1
InChIInChI=1S/C8H17N3/c1-3-4-6(2)7-5-10-8(9)11-7/h6-7H,3-5H2,1-2H3,(H3,9,10,11)
InChIKeyGVYJUHQCYNYLHH-UHFFFAOYSA-N
XLogP0.71
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-4,5-dihydro-1H-imidazol-2-amine
CID 70319974
5-pentan-2-yl-1-propyl-4,5-dihydroimidazol-2-amine
CID 79509853
1-benzyl-5-pentan-2-yl-4,5-dihydroimidazol-2-amine
CID 79506049
1,2-di(pentan-2-yl)cyclopropane
CID 123763474
2-pentan-2-ylthiirane
CID 123614028
1,2-dimethyl-4-pentan-2-ylcyclopentane
CID 123931283
3-pentan-2-ylazepane
CID 107889859
2-pentan-2-yl-4-(trifluoromethyl)piperidine
CID 107888090
1-(bromomethyl)-4-pentan-2-ylcyclohexane
CID 163505099
3-pentan-2-ylcyclobutan-1-amine
CID 130531889
butane;pentan-2-ylcyclohexane
CID 143682251
ethane;pentan-2-ylcyclohexane
CID 143225886

Frequently Asked Questions

What is the IUPAC name of 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine (CID 79510805) is 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine is CCCC(C)C1CN=C(N)N1.
What is the InChIKey of 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is GVYJUHQCYNYLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-3-4-6(2)7-5-10-8(9)11-7/h6-7H,3-5H2,1-2H3,(H3,9,10,11).
What are the key properties of 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 155.24 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pentan-2-yl-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 79510805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).