N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide

C24H32N2O — CID 57291620

IUPACN,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide
SMILESCC1CCCCN1CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H32N2O/c1-20-12-10-11-18-26(20)19-17-24(23(27)25(2)3,21-13-6-4-7-14-21)22-15-8-5-9-16-22/h4-9,13-16,20H,10-12,17-19H2,1-3H3
InChIKeyIYFWUZFFZXFFSX-UHFFFAOYSA-N
MW364.53 g/mol
LogP4.33
Rot. Bonds6

About N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide

N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide (PubChem CID 57291620) has the molecular formula C24H32N2O and a molecular weight of 364.53 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide
PubChem CID57291620
Molecular FormulaC24H32N2O
Molecular Weight364.53 g/mol
Exact Mass364.25
IUPAC NameN,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide
SMILESCC1CCCCN1CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H32N2O/c1-20-12-10-11-18-26(20)19-17-24(23(27)25(2)3,21-13-6-4-7-14-21)22-15-8-5-9-16-22/h4-9,13-16,20H,10-12,17-19H2,1-3H3
InChIKeyIYFWUZFFZXFFSX-UHFFFAOYSA-N
XLogP4.33
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.53
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide?
The IUPAC name of N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide (CID 57291620) is N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide.
What is the SMILES notation for N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide?
The canonical SMILES for N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide is CC1CCCCN1CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide?
The InChIKey is IYFWUZFFZXFFSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O/c1-20-12-10-11-18-26(20)19-17-24(23(27)25(2)3,21-13-6-4-7-14-21)22-15-8-5-9-16-22/h4-9,13-16,20H,10-12,17-19H2,1-3H3.
What are the key properties of N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide?
N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide has a molecular weight of 364.53 g/mol, XLogP of 4.33, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-methylpiperidin-1-yl)-2,2-diphenylbutanamide is sourced from PubChem (CID 57291620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).