(2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol

C17H21NO2 — CID 111466419

IUPAC(2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol
SMILESCOc1ccccc1-c1ccc(CN[C@H](C)CO)cc1
InChIInChI=1S/C17H21NO2/c1-13(12-19)18-11-14-7-9-15(10-8-14)16-5-3-4-6-17(16)20-2/h3-10,13,18-19H,11-12H2,1-2H3/t13-/m1/s1
InChIKeyZCVDSFNEUFOXCQ-CYBMUJFWSA-N
MW271.36 g/mol
LogP2.83
Rot. Bonds6

About (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol

(2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol (PubChem CID 111466419) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol.

Molecular Properties

Compound Name(2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol
PubChem CID111466419
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name(2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol
SMILESCOc1ccccc1-c1ccc(CN[C@H](C)CO)cc1
InChIInChI=1S/C17H21NO2/c1-13(12-19)18-11-14-7-9-15(10-8-14)16-5-3-4-6-17(16)20-2/h3-10,13,18-19H,11-12H2,1-2H3/t13-/m1/s1
InChIKeyZCVDSFNEUFOXCQ-CYBMUJFWSA-N
XLogP2.83
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(3,4-dimethoxyphenyl)methylamino]propan-1-ol
CID 114985562
N-[[4-(2-methoxyphenyl)phenyl]methyl]propan-1-amine
CID 54911552
2-[(4-methoxy-3-methylphenyl)methylamino]propan-1-ol
CID 43776404
N-[[4-(2-methoxyphenyl)phenyl]methyl]propanamide
CID 66848573
1-methoxy-2-[4-[4-(2-methoxyphenyl)phenyl]phenyl]benzene
CID 86116478
N-[(2S)-1-hydroxypropan-2-yl]-4-[[4-(2-methoxyphenyl)phenyl]methyl]oxane-4-carboxamide
CID 124987428
3-[4-(2-methoxyphenyl)phenyl]-2-methylpropanoic acid
CID 70029206
4-[(1-hydroxypropan-2-ylamino)methyl]phenol
CID 43499774
1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-[[4-(2-methoxyphenyl)phenyl]methyl]ethanamine
CID 119138687
4-[[4-(2-methoxyphenyl)phenyl]methylamino]-3,3-dimethylbutan-1-ol
CID 119138820
(2R)-2-[(4-cyclopropylphenyl)methylamino]propan-1-ol
CID 114985652
4-[[4-(2-methoxyphenyl)phenyl]methylamino]butanoic acid
CID 122035871

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol?
The IUPAC name of (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol (CID 111466419) is (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol.
What is the SMILES notation for (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol?
The canonical SMILES for (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol is COc1ccccc1-c1ccc(CN[C@H](C)CO)cc1.
What is the InChIKey of (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol?
The InChIKey is ZCVDSFNEUFOXCQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H21NO2/c1-13(12-19)18-11-14-7-9-15(10-8-14)16-5-3-4-6-17(16)20-2/h3-10,13,18-19H,11-12H2,1-2H3/t13-/m1/s1.
What are the key properties of (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol?
(2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol has a molecular weight of 271.36 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[4-(2-methoxyphenyl)phenyl]methylamino]propan-1-ol is sourced from PubChem (CID 111466419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).