N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide

C18H28N4O2 — CID 71874325

IUPACN,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide
SMILESCc1cc(NC(=O)NCCN2CCCCC2)ccc1C(=O)N(C)C
InChIInChI=1S/C18H28N4O2/c1-14-13-15(7-8-16(14)17(23)21(2)3)20-18(24)19-9-12-22-10-5-4-6-11-22/h7-8,13H,4-6,9-12H2,1-3H3,(H2,19,20,24)
InChIKeySKXLSZRYUQEOKY-UHFFFAOYSA-N
MW332.45 g/mol
LogP2.30
Rot. Bonds5

About N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide

N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide (PubChem CID 71874325) has the molecular formula C18H28N4O2 and a molecular weight of 332.45 g/mol. Its IUPAC name is N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide.

Molecular Properties

Compound NameN,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide
PubChem CID71874325
Molecular FormulaC18H28N4O2
Molecular Weight332.45 g/mol
Exact Mass332.22
IUPAC NameN,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide
SMILESCc1cc(NC(=O)NCCN2CCCCC2)ccc1C(=O)N(C)C
InChIInChI=1S/C18H28N4O2/c1-14-13-15(7-8-16(14)17(23)21(2)3)20-18(24)19-9-12-22-10-5-4-6-11-22/h7-8,13H,4-6,9-12H2,1-3H3,(H2,19,20,24)
InChIKeySKXLSZRYUQEOKY-UHFFFAOYSA-N
XLogP2.30
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide 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

1-(4-acetylphenyl)-3-(2-piperidin-1-ylethyl)urea
CID 60797109
4-[2-(azepan-1-yl)ethylcarbamoylamino]-2-chloro-N-ethylbenzamide
CID 118775045
1-(1,3-benzodioxol-5-yl)-3-(2-piperidin-1-ylethyl)urea
CID 6470232
2-methyl-4-(2-pyrrolidin-1-ylethylamino)benzoic acid
CID 81282265
4-acetamido-N,N,2-trimethylbenzamide
CID 21338871
1-(4-aminophenyl)-3-(2-pyrrolidin-1-ylethyl)urea
CID 55097980
3-methyl-4-(2-pyrrolidin-1-ylethylcarbamoylamino)benzoic acid
CID 62635338
1-(4-amino-3-methoxyphenyl)-3-(2-pyrrolidin-1-ylethyl)urea
CID 89176278
1-(3-chloro-4-methylphenyl)-3-(2-morpholin-4-ylethyl)urea
CID 3579443
1-(4-butan-2-ylphenyl)-3-(2-piperidin-1-ylethyl)urea
CID 6469065
N-(3,4-dimethylphenyl)-3-piperidin-1-ylpropanamide
CID 771569
4-[(2-aminoacetyl)amino]-N,N,2-trimethylbenzamide
CID 119332625

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide?
The IUPAC name of N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide (CID 71874325) is N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide.
What is the SMILES notation for N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide?
The canonical SMILES for N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide is Cc1cc(NC(=O)NCCN2CCCCC2)ccc1C(=O)N(C)C.
What is the InChIKey of N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide?
The InChIKey is SKXLSZRYUQEOKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O2/c1-14-13-15(7-8-16(14)17(23)21(2)3)20-18(24)19-9-12-22-10-5-4-6-11-22/h7-8,13H,4-6,9-12H2,1-3H3,(H2,19,20,24).
What are the key properties of N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide?
N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide has a molecular weight of 332.45 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-4-(2-piperidin-1-ylethylcarbamoylamino)benzamide is sourced from PubChem (CID 71874325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).