3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide

C15H22N4O2 — CID 63131065

IUPAC3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
SMILESCNC(=O)Nc1ccc(NC(=O)C2(C)CCCNC2)cc1
InChIInChI=1S/C15H22N4O2/c1-15(8-3-9-17-10-15)13(20)18-11-4-6-12(7-5-11)19-14(21)16-2/h4-7,17H,3,8-10H2,1-2H3,(H,18,20)(H2,16,19,21)
InChIKeyMLDHXYIOKYQYFW-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.77
Rot. Bonds3

About 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide

3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide (PubChem CID 63131065) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
PubChem CID63131065
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
SMILESCNC(=O)Nc1ccc(NC(=O)C2(C)CCCNC2)cc1
InChIInChI=1S/C15H22N4O2/c1-15(8-3-9-17-10-15)13(20)18-11-4-6-12(7-5-11)19-14(21)16-2/h4-7,17H,3,8-10H2,1-2H3,(H,18,20)(H2,16,19,21)
InChIKeyMLDHXYIOKYQYFW-UHFFFAOYSA-N
XLogP1.77
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.77
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943521
N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 113397758
3-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 63130315
N-(4-methoxyphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943571
3-methyl-N-pyridin-4-ylpiperidine-3-carboxamide;dihydrochloride
CID 119946059
3-methyl-N-[4-(triazol-2-yl)phenyl]piperidine-3-carboxamide
CID 63130247
3-methyl-N-(4-propan-2-yloxyphenyl)piperidine-3-carboxamide;hydrochloride
CID 119944238
3-methyl-N-(4-pentylphenyl)piperidine-3-carboxamide
CID 63134870
N-[4-(ethylcarbamoyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 63131115
3-methyl-N-thiophen-3-ylpiperidine-3-carboxamide
CID 66352634
N-(4-chloro-3-fluorophenyl)-3-methylpiperidine-3-carboxamide
CID 63130654
N-[4-(2-amino-2-oxoethoxy)phenyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119944287

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide?
The IUPAC name of 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide (CID 63131065) is 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide?
The canonical SMILES for 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide is CNC(=O)Nc1ccc(NC(=O)C2(C)CCCNC2)cc1.
What is the InChIKey of 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide?
The InChIKey is MLDHXYIOKYQYFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-15(8-3-9-17-10-15)13(20)18-11-4-6-12(7-5-11)19-14(21)16-2/h4-7,17H,3,8-10H2,1-2H3,(H,18,20)(H2,16,19,21).
What are the key properties of 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide?
3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.77, 3 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 63131065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).