N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide

C20H32N2O — CID 169180328

IUPACN-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide
SMILESCC(C)(C)CNC(=O)C(C)(C)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C20H32N2O/c1-19(2,3)15-21-18(23)20(4,5)22-13-11-17(12-14-22)16-9-7-6-8-10-16/h6-10,17H,11-15H2,1-5H3,(H,21,23)
InChIKeySQVFRAHTXFPSSL-UHFFFAOYSA-N
MW316.49 g/mol
LogP3.81
Rot. Bonds4

About N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide

N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide (PubChem CID 169180328) has the molecular formula C20H32N2O and a molecular weight of 316.49 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide
PubChem CID169180328
Molecular FormulaC20H32N2O
Molecular Weight316.49 g/mol
Exact Mass316.25
IUPAC NameN-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide
SMILESCC(C)(C)CNC(=O)C(C)(C)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C20H32N2O/c1-19(2,3)15-21-18(23)20(4,5)22-13-11-17(12-14-22)16-9-7-6-8-10-16/h6-10,17H,11-15H2,1-5H3,(H,21,23)
InChIKeySQVFRAHTXFPSSL-UHFFFAOYSA-N
XLogP3.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.49
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-3-phenyl-1-(4-phenylpiperidin-1-yl)butan-1-one
CID 110024551
2-methyl-2-(3-phenylpyrrolidin-1-yl)propanoic acid
CID 114997894
2,2-dimethyl-3-[(3-phenylpyrrolidine-1-carbonyl)amino]propanoic acid
CID 115428722
N-(2,2-dimethylpropyl)-2-phenyl-1,3-oxazolidine-3-carboxamide
CID 110749582
2-anilino-1-(4-phenylpiperidin-1-yl)ethanone;hydrochloride
CID 119703042
3,3-dimethyl-1-(4-phenylpiperidin-1-yl)pent-4-en-1-one
CID 72708672
N-(2,2-dimethylpropyl)-4-phenylcyclohexan-1-amine
CID 19381411
2-(4-phenylpiperidin-1-yl)benzoic acid
CID 125468631
2,2-diethyl-1-(4-phenylpiperidin-1-yl)butan-1-one
CID 13249816
2-(4-phenylpiperidin-1-yl)-N-propylacetamide
CID 134001849
N,2,2-trimethyl-3-[(4-phenylcyclohexyl)amino]propanamide
CID 103917259
2,2-dimethyl-1-(4-phenylpiperidin-1-yl)but-3-en-1-one
CID 139215922

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide?
The IUPAC name of N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide (CID 169180328) is N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide is CC(C)(C)CNC(=O)C(C)(C)N1CCC(c2ccccc2)CC1.
What is the InChIKey of N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide?
The InChIKey is SQVFRAHTXFPSSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O/c1-19(2,3)15-21-18(23)20(4,5)22-13-11-17(12-14-22)16-9-7-6-8-10-16/h6-10,17H,11-15H2,1-5H3,(H,21,23).
What are the key properties of N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide?
N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide has a molecular weight of 316.49 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-2-methyl-2-(4-phenylpiperidin-1-yl)propanamide is sourced from PubChem (CID 169180328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).