(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide

C15H17N3O2 — CID 106935047

IUPAC(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide
SMILESCN(C(=O)[C@H](N)Cc1ccc(O)cc1)c1ccncc1
InChIInChI=1S/C15H17N3O2/c1-18(12-6-8-17-9-7-12)15(20)14(16)10-11-2-4-13(19)5-3-11/h2-9,14,19H,10,16H2,1H3/t14-/m1/s1
InChIKeyRGGXGFILQZNEAN-CQSZACIVSA-N
MW271.32 g/mol
LogP1.32
Rot. Bonds4

About (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide

(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide (PubChem CID 106935047) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide
PubChem CID106935047
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide
SMILESCN(C(=O)[C@H](N)Cc1ccc(O)cc1)c1ccncc1
InChIInChI=1S/C15H17N3O2/c1-18(12-6-8-17-9-7-12)15(20)14(16)10-11-2-4-13(19)5-3-11/h2-9,14,19H,10,16H2,1H3/t14-/m1/s1
InChIKeyRGGXGFILQZNEAN-CQSZACIVSA-N
XLogP1.32
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N,N-dimethyl-3-pyridin-4-ylpropanamide
CID 67430342
(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide
CID 107570953
2-amino-N-(4-hydroxyphenyl)-N-methylbutanamide
CID 107734416
(2S)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-(pyridin-3-ylmethyl)propanamide
CID 61155412
(2S)-2-amino-3-(4-hydroxyphenyl)-N-(2-hydroxypropyl)-N-methylpropanamide
CID 55060692
2-amino-N-(2-amino-2-oxoethyl)-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 76893046
(2S)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-propylpropanamide
CID 61154503
(2S)-2-amino-N-cyclopropyl-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 61155702
(2R)-2-amino-N-(2,2-difluoroethyl)-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 104905584
2-amino-N-[2-(dimethylamino)-2-oxoethyl]-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 76893468
methyl 2-amino-3-(4-hydroxyphenyl)propanoate
CID 144819630
(2R)-2-amino-N-butyl-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 104904581

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide?
The IUPAC name of (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide (CID 106935047) is (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide.
What is the SMILES notation for (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide?
The canonical SMILES for (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide is CN(C(=O)[C@H](N)Cc1ccc(O)cc1)c1ccncc1.
What is the InChIKey of (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide?
The InChIKey is RGGXGFILQZNEAN-CQSZACIVSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-18(12-6-8-17-9-7-12)15(20)14(16)10-11-2-4-13(19)5-3-11/h2-9,14,19H,10,16H2,1H3/t14-/m1/s1.
What are the key properties of (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide?
(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide has a molecular weight of 271.32 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide is sourced from PubChem (CID 106935047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).