(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide

C16H24N2O — CID 100844501

IUPAC(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide
SMILESC[C@@H]1C[C@@H](C)CN([C@H](C)C(=O)Nc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-12-9-13(2)11-18(10-12)14(3)16(19)17-15-7-5-4-6-8-15/h4-8,12-14H,9-11H2,1-3H3,(H,17,19)/t12-,13-,14-/m1/s1
InChIKeyZTFTWPABVCSKJG-MGPQQGTHSA-N
MW260.38 g/mol
LogP2.99
Rot. Bonds3

About (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide

(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide (PubChem CID 100844501) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide
PubChem CID100844501
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide
SMILESC[C@@H]1C[C@@H](C)CN([C@H](C)C(=O)Nc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-12-9-13(2)11-18(10-12)14(3)16(19)17-15-7-5-4-6-8-15/h4-8,12-14H,9-11H2,1-3H3,(H,17,19)/t12-,13-,14-/m1/s1
InChIKeyZTFTWPABVCSKJG-MGPQQGTHSA-N
XLogP2.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(4-chlorophenyl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 98319058
2-(3-amino-4-methylpyrrolidin-1-yl)-N-phenylpropanamide
CID 103576816
(2S)-N-(3-bromophenyl)-2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propanamide
CID 9430772
(2S)-N-(3-bromophenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 9430774
N-(3-chlorophenyl)-2-(3,5-dimethylpiperidin-1-yl)propanamide
CID 18083488
N-(3-cyanophenyl)-2-(3,5-dimethylpiperidin-1-yl)propanamide
CID 18083490
(2S)-N-(2,6-difluorophenyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propanamide
CID 9430854
1-[1-(3-bromoanilino)-1-oxopropan-2-yl]-5-methylpiperidine-3-carboxylic acid
CID 122121558
N-(3,4-difluorophenyl)-2-(3,5-dimethylpiperidin-1-yl)propanamide
CID 24506608
2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-phenylpropanamide
CID 78962370
2-(3,5-dimethylpiperidin-1-yl)-1-phenylpropan-1-one
CID 43227828
N-phenyl-2-piperidin-1-ylpropanamide
CID 4788909

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide?
The IUPAC name of (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide (CID 100844501) is (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide.
What is the SMILES notation for (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide?
The canonical SMILES for (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide is C[C@@H]1C[C@@H](C)CN([C@H](C)C(=O)Nc2ccccc2)C1.
What is the InChIKey of (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide?
The InChIKey is ZTFTWPABVCSKJG-MGPQQGTHSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-9-13(2)11-18(10-12)14(3)16(19)17-15-7-5-4-6-8-15/h4-8,12-14H,9-11H2,1-3H3,(H,17,19)/t12-,13-,14-/m1/s1.
What are the key properties of (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide?
(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide is sourced from PubChem (CID 100844501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).