2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol

C13H21NO2 — CID 61057006

IUPAC2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)c1ccccc1OC
InChIInChI=1S/C13H21NO2/c1-4-9-14-13(2,10-15)11-7-5-6-8-12(11)16-3/h5-8,14-15H,4,9-10H2,1-3H3
InChIKeyOZPKDHGJAORITA-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.90
Rot. Bonds6

About 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol

2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol (PubChem CID 61057006) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol
PubChem CID61057006
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)c1ccccc1OC
InChIInChI=1S/C13H21NO2/c1-4-9-14-13(2,10-15)11-7-5-6-8-12(11)16-3/h5-8,14-15H,4,9-10H2,1-3H3
InChIKeyOZPKDHGJAORITA-UHFFFAOYSA-N
XLogP1.90
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethoxyphenyl)-2-(propylamino)propan-1-ol
CID 61056385
2-(2-methylphenyl)-2-(propylamino)propan-1-ol
CID 61055182
2-(benzylamino)-2-(2-methoxyphenyl)propan-1-ol
CID 61044896
2-(4-bromoanilino)-2-(2-methoxyphenyl)propan-1-ol
CID 61049055
2-(2-chloroanilino)-2-(2-methoxyphenyl)propan-1-ol
CID 61049736
(2S)-2-amino-2-(2-methoxyphenyl)propan-1-ol
CID 55277390
4-(2,6-dimethoxyphenoxy)-2-methyl-2-(propylamino)butan-1-ol
CID 64803042
(2S)-2-(2-methoxyphenyl)butan-2-ol
CID 93303591
2-ethyl-5-(2-methoxyphenoxy)-2-(propylamino)pentan-1-ol
CID 106810528
1-methoxy-2-(2-methoxypropan-2-yl)benzene
CID 58091763
2-(2,6-difluorophenyl)-2-(propylamino)propan-1-ol
CID 61053956
methyl 3-(2,5-dimethoxyphenyl)-3-(propylamino)butanoate
CID 65236015

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol?
The IUPAC name of 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol (CID 61057006) is 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol.
What is the SMILES notation for 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol?
The canonical SMILES for 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol is CCCNC(C)(CO)c1ccccc1OC.
What is the InChIKey of 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol?
The InChIKey is OZPKDHGJAORITA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-4-9-14-13(2,10-15)11-7-5-6-8-12(11)16-3/h5-8,14-15H,4,9-10H2,1-3H3.
What are the key properties of 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol?
2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol has a molecular weight of 223.32 g/mol, XLogP of 1.90, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-2-(propylamino)propan-1-ol is sourced from PubChem (CID 61057006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).