N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide

C15H23N3O — CID 54902739

IUPACN,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide
SMILESCc1ccc(C(=O)N(C)C)cc1NC1CCNCC1
InChIInChI=1S/C15H23N3O/c1-11-4-5-12(15(19)18(2)3)10-14(11)17-13-6-8-16-9-7-13/h4-5,10,13,16-17H,6-9H2,1-3H3
InChIKeyVDENGBHAKUMVTP-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.86
Rot. Bonds3

About N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide

N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide (PubChem CID 54902739) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide.

Molecular Properties

Compound NameN,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide
PubChem CID54902739
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide
SMILESCc1ccc(C(=O)N(C)C)cc1NC1CCNCC1
InChIInChI=1S/C15H23N3O/c1-11-4-5-12(15(19)18(2)3)10-14(11)17-13-6-8-16-9-7-13/h4-5,10,13,16-17H,6-9H2,1-3H3
InChIKeyVDENGBHAKUMVTP-UHFFFAOYSA-N
XLogP1.86
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azepan-4-ylamino)-N,N,4-trimethylbenzamide
CID 103981185
N,N-dimethyl-3-nitro-4-(piperidin-4-ylamino)benzamide
CID 82993215
4-methyl-3-(pyrrolidin-3-ylamino)benzoic acid
CID 79731598
N,N,3-trimethyl-4-piperidin-4-ylbenzamide
CID 70330604
3-[(2,2-dimethylcyclopentyl)amino]-N,N,4-trimethylbenzamide
CID 79860799
N,N,4-trimethyl-3-[(2-methylthian-3-yl)amino]benzamide
CID 79956560
N-[4-methyl-3-(piperidin-4-ylamino)phenyl]propanamide
CID 61016600
4-amino-N,N-dimethyl-3-(oxan-4-ylamino)benzamide
CID 63360793
N,N,4-trimethyl-3-[(2-pyrrolidin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119719098
N,N-dimethyl-2-(pyrrolidin-3-ylamino)benzamide
CID 79731257
3-(6-bicyclo[3.2.0]hept-3-enylamino)-N,N,4-trimethylbenzamide
CID 43783528
3-(cycloheptylamino)-N,4-dimethylbenzamide
CID 43726864

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide?
The IUPAC name of N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide (CID 54902739) is N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide.
What is the SMILES notation for N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide?
The canonical SMILES for N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide is Cc1ccc(C(=O)N(C)C)cc1NC1CCNCC1.
What is the InChIKey of N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide?
The InChIKey is VDENGBHAKUMVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-4-5-12(15(19)18(2)3)10-14(11)17-13-6-8-16-9-7-13/h4-5,10,13,16-17H,6-9H2,1-3H3.
What are the key properties of N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide?
N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide has a molecular weight of 261.37 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-3-(piperidin-4-ylamino)benzamide is sourced from PubChem (CID 54902739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).