5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol

C18H32N2O — CID 106808938

IUPAC5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol
SMILESCCCNC(CC)(CO)CCCN(C)c1ccccc1C
InChIInChI=1S/C18H32N2O/c1-5-13-19-18(6-2,15-21)12-9-14-20(4)17-11-8-7-10-16(17)3/h7-8,10-11,19,21H,5-6,9,12-15H2,1-4H3
InChIKeyAPFHYSPLFORVPP-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.35
Rot. Bonds10

About 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol

5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol (PubChem CID 106808938) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol.

Molecular Properties

Compound Name5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol
PubChem CID106808938
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC Name5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol
SMILESCCCNC(CC)(CO)CCCN(C)c1ccccc1C
InChIInChI=1S/C18H32N2O/c1-5-13-19-18(6-2,15-21)12-9-14-20(4)17-11-8-7-10-16(17)3/h7-8,10-11,19,21H,5-6,9,12-15H2,1-4H3
InChIKeyAPFHYSPLFORVPP-UHFFFAOYSA-N
XLogP3.35
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(N,2-dimethylanilino)-2-ethyl-2-(ethylamino)pentan-1-ol
CID 106808939
5-(N,2-dimethylanilino)-2-methyl-2-(propylamino)pentan-1-ol
CID 64789948
4-(N,2-dimethylanilino)-2-methyl-2-(propylamino)butan-1-ol
CID 64790737
4-(N,2-dimethylanilino)-2-(ethylamino)-2-methylbutan-1-ol
CID 64791132
N-tert-butyl-N'-methyl-N'-(2-methylphenyl)propane-1,3-diamine
CID 55069200
2-ethyl-5-[3-methoxypropyl(methyl)amino]-2-(propylamino)pentan-1-ol
CID 106808842
5-[2-(dimethylamino)ethyl-propylamino]-2-ethyl-2-(propylamino)pentan-1-ol
CID 106808957
N,2-dimethyl-N-propylaniline
CID 69435269
4-(N-ethyl-2-methylanilino)-2-methyl-2-(propylamino)butan-1-ol
CID 64790380
2-ethyl-5-(2-methoxyphenoxy)-2-(propylamino)pentan-1-ol
CID 106810528
6-(N,2-dimethylanilino)hexan-3-one
CID 106801284
5-[cyclopentylmethyl(methyl)amino]-2-ethyl-2-(propylamino)pentan-1-ol
CID 106808716

Frequently Asked Questions

What is the IUPAC name of 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol?
The IUPAC name of 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol (CID 106808938) is 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol.
What is the SMILES notation for 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol?
The canonical SMILES for 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol is CCCNC(CC)(CO)CCCN(C)c1ccccc1C.
What is the InChIKey of 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol?
The InChIKey is APFHYSPLFORVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c1-5-13-19-18(6-2,15-21)12-9-14-20(4)17-11-8-7-10-16(17)3/h7-8,10-11,19,21H,5-6,9,12-15H2,1-4H3.
What are the key properties of 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol?
5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol has a molecular weight of 292.47 g/mol, XLogP of 3.35, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(N,2-dimethylanilino)-2-ethyl-2-(propylamino)pentan-1-ol is sourced from PubChem (CID 106808938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).