1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol

C14H23NO2 — CID 62064652

IUPAC1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol
SMILESCCCN(C)CC(O)COCc1ccccc1
InChIInChI=1S/C14H23NO2/c1-3-9-15(2)10-14(16)12-17-11-13-7-5-4-6-8-13/h4-8,14,16H,3,9-12H2,1-2H3
InChIKeyFQKVHCFNKZSHBL-UHFFFAOYSA-N
MW237.34 g/mol
LogP1.91
Rot. Bonds8

About 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol

1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol (PubChem CID 62064652) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol.

Molecular Properties

Compound Name1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol
PubChem CID62064652
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol
SMILESCCCN(C)CC(O)COCc1ccccc1
InChIInChI=1S/C14H23NO2/c1-3-9-15(2)10-14(16)12-17-11-13-7-5-4-6-8-13/h4-8,14,16H,3,9-12H2,1-2H3
InChIKeyFQKVHCFNKZSHBL-UHFFFAOYSA-N
XLogP1.91
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[methyl(prop-2-enyl)amino]-3-phenylmethoxypropan-2-ol
CID 111333519
(2R)-1-[methyl(2,2,2-trifluoroethyl)amino]-3-phenylmethoxypropan-2-ol
CID 95356220
(2R)-1-[2-bromoprop-2-enyl(methyl)amino]-3-phenylmethoxypropan-2-ol
CID 95629005
(2S)-1-[2-chloroprop-2-enyl(methyl)amino]-3-phenylmethoxypropan-2-ol
CID 95629006
1-[methyl(1-methylsulfanylbutan-2-yl)amino]-3-phenylmethoxypropan-2-ol
CID 115898094
(2R)-1-[(4-methoxyphenyl)methyl-propylamino]-3-phenylmethoxypropan-2-ol
CID 93160595
1-phenylmethoxy-3-[propyl(thiophen-3-ylmethyl)amino]propan-2-ol
CID 24713472
1-[1-cyclopropylethyl(methyl)amino]-3-phenylmethoxypropan-2-ol
CID 60724056
1-[2-[2-[[(2R)-2-hydroxy-3-phenylmethoxypropyl]-methylamino]ethyl]-5-methyl-1H-imidazol-4-yl]ethanone
CID 97066525
N-[2-[[2-hydroxy-3-(pyridin-4-ylmethoxy)propyl]-methylamino]ethyl]-N-methyl-2,2-diphenylacetamide
CID 139685675
N-[3-[[[(2S)-2-hydroxy-3-phenylmethoxypropyl]-methylamino]methyl]phenyl]acetamide
CID 96547844
N-(2-ethoxy-3-phenylmethoxypropyl)-N-methyloctadecan-1-amine
CID 19897854

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol?
The IUPAC name of 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol (CID 62064652) is 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol.
What is the SMILES notation for 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol?
The canonical SMILES for 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol is CCCN(C)CC(O)COCc1ccccc1.
What is the InChIKey of 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol?
The InChIKey is FQKVHCFNKZSHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-3-9-15(2)10-14(16)12-17-11-13-7-5-4-6-8-13/h4-8,14,16H,3,9-12H2,1-2H3.
What are the key properties of 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol?
1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol has a molecular weight of 237.34 g/mol, XLogP of 1.91, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(propyl)amino]-3-phenylmethoxypropan-2-ol is sourced from PubChem (CID 62064652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).