2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol

C16H31N3O — CID 106809992

IUPAC2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol
SMILESCCCNC(CC)(CO)CCCn1ccnc1CCC
InChIInChI=1S/C16H31N3O/c1-4-8-15-17-11-13-19(15)12-7-9-16(6-3,14-20)18-10-5-2/h11,13,18,20H,4-10,12,14H2,1-3H3
InChIKeyVLZSXKHXOMQSMW-UHFFFAOYSA-N
MW281.44 g/mol
LogP2.76
Rot. Bonds11

About 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol

2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol (PubChem CID 106809992) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol
PubChem CID106809992
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol
SMILESCCCNC(CC)(CO)CCCn1ccnc1CCC
InChIInChI=1S/C16H31N3O/c1-4-8-15-17-11-13-19(15)12-7-9-16(6-3,14-20)18-10-5-2/h11,13,18,20H,4-10,12,14H2,1-3H3
InChIKeyVLZSXKHXOMQSMW-UHFFFAOYSA-N
XLogP2.76
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-2-(propan-2-ylamino)-5-(2-propylimidazol-1-yl)pentanoic acid
CID 106806662
2-methyl-5-(2-propan-2-ylimidazol-1-yl)-2-(propylamino)pentan-1-ol
CID 64811296
2-ethyl-2-(methylamino)-5-(2-propan-2-ylimidazol-1-yl)pentan-1-ol
CID 106810004
2-(cyclopropylamino)-5-(2-ethylimidazol-1-yl)-2-methylpentan-1-ol
CID 64809678
1-(4-methylpentyl)-2-propylimidazole
CID 83169083
2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol
CID 64809827
1,2-di(pentadecyl)imidazole
CID 69388452
4-(2-ethylimidazol-1-yl)-N-propylbutan-1-amine
CID 62440432
5-(2,4-dimethylphenoxy)-2-ethyl-2-(propylamino)pentan-1-ol
CID 106810447
2,2-dimethyl-N-propyl-3-(2-propylimidazol-1-yl)propan-1-amine
CID 79621146
(2-butylimidazol-1-yl)methanol
CID 22012500
5-[(3-chloro-2-pyridinyl)sulfanyl]-2-ethyl-2-(propylamino)pentan-1-ol
CID 106811134

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol?
The IUPAC name of 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol (CID 106809992) is 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol.
What is the SMILES notation for 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol?
The canonical SMILES for 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol is CCCNC(CC)(CO)CCCn1ccnc1CCC.
What is the InChIKey of 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol?
The InChIKey is VLZSXKHXOMQSMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-4-8-15-17-11-13-19(15)12-7-9-16(6-3,14-20)18-10-5-2/h11,13,18,20H,4-10,12,14H2,1-3H3.
What are the key properties of 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol?
2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol has a molecular weight of 281.44 g/mol, XLogP of 2.76, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol is sourced from PubChem (CID 106809992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).