(2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide

C19H24N4O2 — CID 98857991

IUPAC(2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide
SMILESCc1noc([C@H]2CCCN([C@@H](C(=O)NC3CC3)c3ccccc3)C2)n1
InChIInChI=1S/C19H24N4O2/c1-13-20-19(25-22-13)15-8-5-11-23(12-15)17(14-6-3-2-4-7-14)18(24)21-16-9-10-16/h2-4,6-7,15-17H,5,8-12H2,1H3,(H,21,24)/t15-,17+/m0/s1
InChIKeyIVWZHJOEOHRACZ-DOTOQJQBSA-N
MW340.43 g/mol
LogP2.58
Rot. Bonds5

About (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide

(2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide (PubChem CID 98857991) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide
PubChem CID98857991
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name(2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide
SMILESCc1noc([C@H]2CCCN([C@@H](C(=O)NC3CC3)c3ccccc3)C2)n1
InChIInChI=1S/C19H24N4O2/c1-13-20-19(25-22-13)15-8-5-11-23(12-15)17(14-6-3-2-4-7-14)18(24)21-16-9-10-16/h2-4,6-7,15-17H,5,8-12H2,1H3,(H,21,24)/t15-,17+/m0/s1
InChIKeyIVWZHJOEOHRACZ-DOTOQJQBSA-N
XLogP2.58
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-[(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-[(1R)-1-phenylethyl]propanamide
CID 124859531
2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-(1-phenylethyl)propanamide
CID 71939627
1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3,3-diphenylpropan-1-one
CID 51120866
2-(1,1-dioxo-1,4-thiazinan-4-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylethanone
CID 56540355
(2R)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide
CID 94571895
2-(4-bromo-2-fluorophenyl)-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]acetic acid
CID 146134871
(2R)-N-cyclopropyl-2-phenyl-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 98755732
(2S)-N-cyclopropyl-2-phenyl-2-[(3S)-3-phenylpyrrolidin-1-yl]acetamide
CID 95298740
(2S)-N-cyclopropyl-2-[(3S)-3-(1,3-dioxolan-2-yl)piperidin-1-yl]-2-phenylacetamide
CID 95283443
(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-propan-2-ylpiperidine-1-carboxamide
CID 94178848
N-[[dimethyl(phenyl)silyl]methyl]-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
CID 119038571
[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(4-phenylphenyl)methanone
CID 47061019

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide?
The IUPAC name of (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide (CID 98857991) is (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide.
What is the SMILES notation for (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide?
The canonical SMILES for (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide is Cc1noc([C@H]2CCCN([C@@H](C(=O)NC3CC3)c3ccccc3)C2)n1.
What is the InChIKey of (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide?
The InChIKey is IVWZHJOEOHRACZ-DOTOQJQBSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13-20-19(25-22-13)15-8-5-11-23(12-15)17(14-6-3-2-4-7-14)18(24)21-16-9-10-16/h2-4,6-7,15-17H,5,8-12H2,1H3,(H,21,24)/t15-,17+/m0/s1.
What are the key properties of (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide?
(2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide has a molecular weight of 340.43 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopropyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-phenylacetamide is sourced from PubChem (CID 98857991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).