(2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide

C17H24N6O2 — CID 97207664

IUPAC(2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide
SMILESCCCn1cnnc1CNC(=O)[C@@H](c1cccnc1)N1CCOCC1
InChIInChI=1S/C17H24N6O2/c1-2-6-23-13-20-21-15(23)12-19-17(24)16(14-4-3-5-18-11-14)22-7-9-25-10-8-22/h3-5,11,13,16H,2,6-10,12H2,1H3,(H,19,24)/t16-/m1/s1
InChIKeyPHBSYWHNUWIDCF-MRXNPFEDSA-N
MW344.42 g/mol
LogP0.77
Rot. Bonds7

About (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide

(2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide (PubChem CID 97207664) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound Name(2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide
PubChem CID97207664
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC Name(2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide
SMILESCCCn1cnnc1CNC(=O)[C@@H](c1cccnc1)N1CCOCC1
InChIInChI=1S/C17H24N6O2/c1-2-6-23-13-20-21-15(23)12-19-17(24)16(14-4-3-5-18-11-14)22-7-9-25-10-8-22/h3-5,11,13,16H,2,6-10,12H2,1H3,(H,19,24)/t16-/m1/s1
InChIKeyPHBSYWHNUWIDCF-MRXNPFEDSA-N
XLogP0.77
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide with MolForge

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Related Compounds

2-morpholin-4-yl-N-[(1-phenyltetrazol-5-yl)methyl]-2-pyridin-3-ylacetamide
CID 72904137
N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 72855093
N-[(2-imidazol-1-yl-3-pyridinyl)methyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 56705378
N-(cyclohexen-1-ylmethyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 56755952
(2S)-N-[(2,4-difluorophenyl)methyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97131048
N-[2-(dimethylsulfamoyl)ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 74234487
(2R)-N-[2-(2-fluorophenyl)ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97192696
N-benzyl-2-(4-methylpiperazin-1-yl)-2-pyridin-3-ylacetamide
CID 164930531
N-[2-(5-methylfuran-2-yl)ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 72889150
N-[3-(2-methyl-6-oxo-1-pyridinyl)propyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 72936879
N-(2-ethylsulfanylphenyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 131917262
(2R)-N-(2-cyclohexylsulfanylethyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97188095

Frequently Asked Questions

What is the IUPAC name of (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide?
The IUPAC name of (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide (CID 97207664) is (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide is CCCn1cnnc1CNC(=O)[C@@H](c1cccnc1)N1CCOCC1.
What is the InChIKey of (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide?
The InChIKey is PHBSYWHNUWIDCF-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-2-6-23-13-20-21-15(23)12-19-17(24)16(14-4-3-5-18-11-14)22-7-9-25-10-8-22/h3-5,11,13,16H,2,6-10,12H2,1H3,(H,19,24)/t16-/m1/s1.
What are the key properties of (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide?
(2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide has a molecular weight of 344.42 g/mol, XLogP of 0.77, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-morpholin-4-yl-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 97207664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).