4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide

C15H23N3O2 — CID 62659783

IUPAC4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide
SMILESCOc1ccc(C(N)=O)cc1NCC1CCCN(C)C1
InChIInChI=1S/C15H23N3O2/c1-18-7-3-4-11(10-18)9-17-13-8-12(15(16)19)5-6-14(13)20-2/h5-6,8,11,17H,3-4,7,9-10H2,1-2H3,(H2,16,19)
InChIKeyUYGLWPWGDQIBRP-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.55
Rot. Bonds5

About 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide

4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide (PubChem CID 62659783) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide.

Molecular Properties

Compound Name4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide
PubChem CID62659783
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide
SMILESCOc1ccc(C(N)=O)cc1NCC1CCCN(C)C1
InChIInChI=1S/C15H23N3O2/c1-18-7-3-4-11(10-18)9-17-13-8-12(15(16)19)5-6-14(13)20-2/h5-6,8,11,17H,3-4,7,9-10H2,1-2H3,(H2,16,19)
InChIKeyUYGLWPWGDQIBRP-UHFFFAOYSA-N
XLogP1.55
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-4-[(1-methylpiperidin-3-yl)methylamino]benzamide
CID 62656715
3-(cyclohex-3-en-1-ylmethylamino)-4-methoxybenzamide
CID 43735274
methyl 4-chloro-3-[(1-methylpiperidin-3-yl)methylamino]benzoate
CID 62656913
3-bromo-4-[(1-methylpiperidin-3-yl)methylamino]benzoic acid
CID 82801301
4-methoxy-3-(prop-2-ynylamino)benzamide
CID 63952284
2,4-difluoro-5-[(1-methylpiperidin-3-yl)methylamino]benzamide
CID 62654718
3-amino-N,N-dimethyl-4-[(1-methylpiperidin-3-yl)methylamino]benzamide
CID 82990765
3-chloro-4-methoxy-N-[(1-methylpiperidin-3-yl)methyl]aniline
CID 55100033
3,4-dimethoxy-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
CID 110737466
3-amino-N-ethyl-4-[(1-methylpiperidin-3-yl)methylamino]benzamide
CID 82989904
4-chloro-3-(cyclohexylmethylamino)benzamide
CID 43679468
2-[(1-methylpiperidin-3-yl)methylamino]-5-nitrobenzamide
CID 133454540

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide?
The IUPAC name of 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide (CID 62659783) is 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide.
What is the SMILES notation for 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide?
The canonical SMILES for 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide is COc1ccc(C(N)=O)cc1NCC1CCCN(C)C1.
What is the InChIKey of 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide?
The InChIKey is UYGLWPWGDQIBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-18-7-3-4-11(10-18)9-17-13-8-12(15(16)19)5-6-14(13)20-2/h5-6,8,11,17H,3-4,7,9-10H2,1-2H3,(H2,16,19).
What are the key properties of 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide?
4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide has a molecular weight of 277.37 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-[(1-methylpiperidin-3-yl)methylamino]benzamide is sourced from PubChem (CID 62659783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).