N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide

C15H23N3O — CID 106633432

IUPACN,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide
SMILESCNC(=O)c1ccc(C)c(NCC2CCCCN2)c1
InChIInChI=1S/C15H23N3O/c1-11-6-7-12(15(19)16-2)9-14(11)18-10-13-5-3-4-8-17-13/h6-7,9,13,17-18H,3-5,8,10H2,1-2H3,(H,16,19)
InChIKeyQHAVFPNGYWEDNZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.91
Rot. Bonds4

About N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide

N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide (PubChem CID 106633432) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide.

Molecular Properties

Compound NameN,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide
PubChem CID106633432
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide
SMILESCNC(=O)c1ccc(C)c(NCC2CCCCN2)c1
InChIInChI=1S/C15H23N3O/c1-11-6-7-12(15(19)16-2)9-14(11)18-10-13-5-3-4-8-17-13/h6-7,9,13,17-18H,3-5,8,10H2,1-2H3,(H,16,19)
InChIKeyQHAVFPNGYWEDNZ-UHFFFAOYSA-N
XLogP1.91
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-nitro-3-(pyrrolidin-2-ylmethylamino)benzamide
CID 82989014
3-bromo-4-methyl-N-(piperidin-2-ylmethyl)benzamide
CID 81472136
3-(cycloheptylamino)-N,4-dimethylbenzamide
CID 43726864
2,5-dimethyl-4-(piperidin-2-ylmethylamino)phenol
CID 106953789
3-(2,2-dimethylpropylamino)-N,4-dimethylbenzamide
CID 61325560
3-(butylamino)-N,4-dimethylbenzamide
CID 43726955
N-ethyl-4-methyl-3-(1-pyrrolidin-2-ylpropan-2-ylamino)benzamide
CID 79538042
4,5-dimethoxy-2-methyl-N-(piperidin-2-ylmethyl)aniline
CID 106633371
3-methoxy-4-methyl-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119509893
2-chloro-4-methyl-N-(piperidin-2-ylmethyl)aniline
CID 106633070
2,6-dimethyl-3-(pyrrolidin-2-ylmethylamino)phenol
CID 106637684
4-amino-3-(cyclobutylmethylamino)-N-methylbenzamide
CID 63357593

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide?
The IUPAC name of N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide (CID 106633432) is N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide.
What is the SMILES notation for N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide?
The canonical SMILES for N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide is CNC(=O)c1ccc(C)c(NCC2CCCCN2)c1.
What is the InChIKey of N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide?
The InChIKey is QHAVFPNGYWEDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-6-7-12(15(19)16-2)9-14(11)18-10-13-5-3-4-8-17-13/h6-7,9,13,17-18H,3-5,8,10H2,1-2H3,(H,16,19).
What are the key properties of N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide?
N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide has a molecular weight of 261.37 g/mol, XLogP of 1.91, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-3-(piperidin-2-ylmethylamino)benzamide is sourced from PubChem (CID 106633432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).