(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide

C15H17N3O — CID 104941421

IUPAC(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide
SMILESCc1cnccc1CNC(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-11-9-17-8-7-13(11)10-18-15(19)14(16)12-5-3-2-4-6-12/h2-9,14H,10,16H2,1H3,(H,18,19)/t14-/m1/s1
InChIKeyMNVUKMQVWRNSMM-CQSZACIVSA-N
MW255.32 g/mol
LogP1.71
Rot. Bonds4

About (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide

(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide (PubChem CID 104941421) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide
PubChem CID104941421
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide
SMILESCc1cnccc1CNC(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-11-9-17-8-7-13(11)10-18-15(19)14(16)12-5-3-2-4-6-12/h2-9,14H,10,16H2,1H3,(H,18,19)/t14-/m1/s1
InChIKeyMNVUKMQVWRNSMM-CQSZACIVSA-N
XLogP1.71
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-3-phenylpropanamide
CID 104941410
(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-4-phenylbutanamide
CID 166260300
(2R)-2-amino-4-methyl-N-[(3-methyl-4-pyridinyl)methyl]pentanamide
CID 104941409
2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide
CID 54896815
(2S)-2-amino-N-[(4-methylthiophen-3-yl)methyl]-2-phenylacetamide
CID 104898150
2-amino-N-[(3-methyl-2-pyridinyl)methyl]-2-phenylacetamide
CID 63306151
(2S)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-4-methylsulfanylbutanamide
CID 104941423
2-(3-chlorophenyl)-N-[(3-methyl-4-pyridinyl)methyl]propanamide
CID 167839767
2-bromo-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114700594
2-(aminomethyl)-4,4-dimethyl-N-[(3-methyl-4-pyridinyl)methyl]pentanamide
CID 107472817
2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide
CID 119850323
2-amino-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-phenylacetamide
CID 112669565

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide (CID 104941421) is (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide is Cc1cnccc1CNC(=O)[C@H](N)c1ccccc1.
What is the InChIKey of (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide?
The InChIKey is MNVUKMQVWRNSMM-CQSZACIVSA-N. The full InChI is InChI=1S/C15H17N3O/c1-11-9-17-8-7-13(11)10-18-15(19)14(16)12-5-3-2-4-6-12/h2-9,14H,10,16H2,1H3,(H,18,19)/t14-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide?
(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide has a molecular weight of 255.32 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide is sourced from PubChem (CID 104941421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).