(2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide

C18H26N2O — CID 51887029

IUPAC(2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide
SMILESC[C@@H]1C[C@@H](C)CN([C@H](C(=O)NC2CC2)c2ccccc2)C1
InChIInChI=1S/C18H26N2O/c1-13-10-14(2)12-20(11-13)17(15-6-4-3-5-7-15)18(21)19-16-8-9-16/h3-7,13-14,16-17H,8-12H2,1-2H3,(H,19,21)/t13-,14-,17+/m1/s1
InChIKeyLSWMVNUKILGFOG-CPUCHLNUSA-N
MW286.42 g/mol
LogP2.98
Rot. Bonds4

About (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide

(2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide (PubChem CID 51887029) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide
PubChem CID51887029
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name(2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide
SMILESC[C@@H]1C[C@@H](C)CN([C@H](C(=O)NC2CC2)c2ccccc2)C1
InChIInChI=1S/C18H26N2O/c1-13-10-14(2)12-20(11-13)17(15-6-4-3-5-7-15)18(21)19-16-8-9-16/h3-7,13-14,16-17H,8-12H2,1-2H3,(H,19,21)/t13-,14-,17+/m1/s1
InChIKeyLSWMVNUKILGFOG-CPUCHLNUSA-N
XLogP2.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide with MolForge

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Related Compounds

(2S)-N-cyclohexyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide
CID 94778967
2-(3,5-dimethylpiperidin-1-yl)-2-phenylacetohydrazide
CID 63568815
2-(3,5-dimethylpiperidin-1-yl)-2-phenyl-N-(4-propan-2-ylphenyl)acetamide
CID 4130031
(2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide
CID 9033825
(2S)-N-cyclopropyl-2-(4-methylpiperazin-1-yl)-2-phenylacetamide
CID 9033055
N-cyclopropyl-2-[3-(methylamino)piperidin-1-yl]-2-phenylacetamide
CID 119918563
(2S)-N-cyclopropyl-2-phenyl-2-[(3S)-3-phenylpyrrolidin-1-yl]acetamide
CID 95298740
(2R)-N-cyclopropyl-2-phenyl-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 98755732
(2S)-N-cyclopropyl-2-[4-(2-methylphenyl)piperazin-1-yl]-2-phenylacetamide
CID 9029671
(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide
CID 100844501
(2R)-N-cyclopropyl-2-phenyl-2-(4-piperidin-1-ylpiperidin-1-yl)acetamide
CID 94797745
N-cyclohexyl-2-(3,5-dimethylpiperidin-1-yl)-4-phenylbutanamide
CID 51361418

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide?
The IUPAC name of (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide (CID 51887029) is (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide.
What is the SMILES notation for (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide?
The canonical SMILES for (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide is C[C@@H]1C[C@@H](C)CN([C@H](C(=O)NC2CC2)c2ccccc2)C1.
What is the InChIKey of (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide?
The InChIKey is LSWMVNUKILGFOG-CPUCHLNUSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13-10-14(2)12-20(11-13)17(15-6-4-3-5-7-15)18(21)19-16-8-9-16/h3-7,13-14,16-17H,8-12H2,1-2H3,(H,19,21)/t13-,14-,17+/m1/s1.
What are the key properties of (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide?
(2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide has a molecular weight of 286.42 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide is sourced from PubChem (CID 51887029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).