N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide

C24H29N3O3 — CID 51942969

IUPACN-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide
SMILESC[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)CNC(=O)Cc2ccccc2)C1
InChIInChI=1S/C24H29N3O3/c1-17-12-18(2)16-27(15-17)24(30)20-10-6-7-11-21(20)26-23(29)14-25-22(28)13-19-8-4-3-5-9-19/h3-11,17-18H,12-16H2,1-2H3,(H,25,28)(H,26,29)/t17-,18-/m1/s1
InChIKeySKAIEKSPAXTRFM-QZTJIDSGSA-N
MW407.51 g/mol
LogP3.10
Rot. Bonds6

About N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide

N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide (PubChem CID 51942969) has the molecular formula C24H29N3O3 and a molecular weight of 407.51 g/mol. Its IUPAC name is N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide
PubChem CID51942969
Molecular FormulaC24H29N3O3
Molecular Weight407.51 g/mol
Exact Mass407.22
IUPAC NameN-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide
SMILESC[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)CNC(=O)Cc2ccccc2)C1
InChIInChI=1S/C24H29N3O3/c1-17-12-18(2)16-27(15-17)24(30)20-10-6-7-11-21(20)26-23(29)14-25-22(28)13-19-8-4-3-5-9-19/h3-11,17-18H,12-16H2,1-2H3,(H,25,28)(H,26,29)/t17-,18-/m1/s1
InChIKeySKAIEKSPAXTRFM-QZTJIDSGSA-N
XLogP3.10
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.51
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[2-(3,5-dimethylpiperidine-1-carbonyl)anilino]-2,2-dimethyl-4-oxobutanoic acid
CID 102554567
N-[3-[2-(3,5-dimethylpiperidine-1-carbonyl)anilino]-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 55677137
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-4-(methylamino)butanamide;hydrochloride
CID 119717948
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 55676731
N-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide
CID 51942966
3-acetamido-N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-3-phenylpropanamide
CID 55677286
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-6-methylpyridine-2-carboxamide
CID 46442735
2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]acetamide
CID 55676703
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 43048910
N'-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-N-[2-(N-methylanilino)ethyl]oxamide
CID 78882681
N-[2-(2-methylanilino)-2-oxoethyl]-2-phenylacetamide
CID 2224642
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119717968

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide?
The IUPAC name of N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide (CID 51942969) is N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide is C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)CNC(=O)Cc2ccccc2)C1.
What is the InChIKey of N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide?
The InChIKey is SKAIEKSPAXTRFM-QZTJIDSGSA-N. The full InChI is InChI=1S/C24H29N3O3/c1-17-12-18(2)16-27(15-17)24(30)20-10-6-7-11-21(20)26-23(29)14-25-22(28)13-19-8-4-3-5-9-19/h3-11,17-18H,12-16H2,1-2H3,(H,25,28)(H,26,29)/t17-,18-/m1/s1.
What are the key properties of N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide?
N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide has a molecular weight of 407.51 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide is sourced from PubChem (CID 51942969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).