(2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide

C21H21N3O2 — CID 146264478

IUPAC(2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide
SMILESCC[C@@H](N)C(=O)Nc1cccc(Oc2ccccc2-c2ccccc2)n1
InChIInChI=1S/C21H21N3O2/c1-2-17(22)21(25)24-19-13-8-14-20(23-19)26-18-12-7-6-11-16(18)15-9-4-3-5-10-15/h3-14,17H,2,22H2,1H3,(H,23,24,25)/t17-/m1/s1
InChIKeyBWZYTGQKGPBLMD-QGZVFWFLSA-N
MW347.42 g/mol
LogP4.22
Rot. Bonds6

About (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide

(2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide (PubChem CID 146264478) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide
PubChem CID146264478
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name(2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide
SMILESCC[C@@H](N)C(=O)Nc1cccc(Oc2ccccc2-c2ccccc2)n1
InChIInChI=1S/C21H21N3O2/c1-2-17(22)21(25)24-19-13-8-14-20(23-19)26-18-12-7-6-11-16(18)15-9-4-3-5-10-15/h3-14,17H,2,22H2,1H3,(H,23,24,25)/t17-/m1/s1
InChIKeyBWZYTGQKGPBLMD-QGZVFWFLSA-N
XLogP4.22
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[2-oxo-2-[[6-(2-phenylphenoxy)-2-pyridinyl]amino]ethyl]carbamate
CID 146265063
2-amino-N-(6-bromo-2-pyridinyl)butanamide;hydrochloride
CID 126623961
(2R)-2-amino-N-[6-(3-methoxy-4-methylphenoxy)-2-pyridinyl]butanamide;2,2,2-trifluoroacetic acid
CID 146264526
1-(1-hydroxy-2-methylpropan-2-yl)-3-(6-phenoxy-2-pyridinyl)urea
CID 167851183
(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide
CID 107570362
2-amino-N-(4-phenyl-1,3-thiazol-2-yl)butanamide
CID 139386677
N-[2-[[6-(ethylamino)-2-pyridinyl]oxy]phenyl]acetamide
CID 80881560
(2S)-2-amino-N-(2-ethoxyphenyl)butanamide
CID 79025438
(2S)-2-amino-N-(2-phenylphenyl)hexanamide
CID 103830910
2-[2-(2-aminobutanoylamino)phenoxy]acetic acid
CID 63745017
2-amino-3-methyl-N-(6-phenyl-2-pyridinyl)butanamide
CID 110481515
[6-(2-ethylphenoxy)-2-pyridinyl]methanol
CID 62240045

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide?
The IUPAC name of (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide (CID 146264478) is (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide.
What is the SMILES notation for (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide?
The canonical SMILES for (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide is CC[C@@H](N)C(=O)Nc1cccc(Oc2ccccc2-c2ccccc2)n1.
What is the InChIKey of (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide?
The InChIKey is BWZYTGQKGPBLMD-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-2-17(22)21(25)24-19-13-8-14-20(23-19)26-18-12-7-6-11-16(18)15-9-4-3-5-10-15/h3-14,17H,2,22H2,1H3,(H,23,24,25)/t17-/m1/s1.
What are the key properties of (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide?
(2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide has a molecular weight of 347.42 g/mol, XLogP of 4.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[6-(2-phenylphenoxy)-2-pyridinyl]butanamide is sourced from PubChem (CID 146264478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).