3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol

C17H29NO — CID 63193572

IUPAC3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol
SMILESCCCN(CCC)CC(C)(C)C(O)c1ccccc1
InChIInChI=1S/C17H29NO/c1-5-12-18(13-6-2)14-17(3,4)16(19)15-10-8-7-9-11-15/h7-11,16,19H,5-6,12-14H2,1-4H3
InChIKeyQDUVJHVNVLEOMC-UHFFFAOYSA-N
MW263.42 g/mol
LogP3.87
Rot. Bonds8

About 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol

3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol (PubChem CID 63193572) has the molecular formula C17H29NO and a molecular weight of 263.42 g/mol. Its IUPAC name is 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol.

Molecular Properties

Compound Name3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol
PubChem CID63193572
Molecular FormulaC17H29NO
Molecular Weight263.42 g/mol
Exact Mass263.22
IUPAC Name3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol
SMILESCCCN(CCC)CC(C)(C)C(O)c1ccccc1
InChIInChI=1S/C17H29NO/c1-5-12-18(13-6-2)14-17(3,4)16(19)15-10-8-7-9-11-15/h7-11,16,19H,5-6,12-14H2,1-4H3
InChIKeyQDUVJHVNVLEOMC-UHFFFAOYSA-N
XLogP3.87
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.42
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-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

3-(dimethylamino)-2,2-dimethyl-1-phenylpropan-1-ol;hydrochloride
CID 117067676
3-[2-hydroxypropyl(methyl)amino]-2,2-dimethyl-1-phenylpropan-1-ol
CID 63193478
2,2-dimethyl-3-[methyl(3-methylbutyl)amino]-1-phenylpropan-1-ol
CID 63194059
3-[ethyl(furan-2-ylmethyl)amino]-2,2-dimethyl-1-phenylpropan-1-ol
CID 63193959
2,2-dimethyl-3-[2-methylpropyl(propan-2-yl)amino]-1-phenylpropan-1-ol
CID 63194009
(1R,2S)-2,3,3-trimethyl-1-phenylbutane-1,2-diol
CID 10774737
2,2-dimethyl-3-[methyl(2-propan-2-yloxyethyl)amino]-1-phenylpropan-1-ol
CID 81074892
3-(N,4-dimethylanilino)-2,2-dimethyl-1-phenylpropan-1-ol
CID 63193525
(1R,3R)-2,2-dimethyl-1,3-diphenylpropane-1,3-diol
CID 100943216
2,2-dimethyl-1-(4-phenylphenyl)butan-1-ol
CID 63426075
3,3-dimethyl-4-phenylbutane-1,2,4-triol
CID 132576079
1-[2-(dimethylamino)ethyl-propylamino]-2-phenylpropan-2-ol
CID 62374488

Frequently Asked Questions

What is the IUPAC name of 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol?
The IUPAC name of 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol (CID 63193572) is 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol.
What is the SMILES notation for 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol?
The canonical SMILES for 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol is CCCN(CCC)CC(C)(C)C(O)c1ccccc1.
What is the InChIKey of 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol?
The InChIKey is QDUVJHVNVLEOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-5-12-18(13-6-2)14-17(3,4)16(19)15-10-8-7-9-11-15/h7-11,16,19H,5-6,12-14H2,1-4H3.
What are the key properties of 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol?
3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol has a molecular weight of 263.42 g/mol, XLogP of 3.87, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dipropylamino)-2,2-dimethyl-1-phenylpropan-1-ol is sourced from PubChem (CID 63193572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).