N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide

C19H29N3O2 — CID 146666591

IUPACN-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(N3CCC(C)CC3)CC2)cc1
InChIInChI=1S/C19H29N3O2/c1-15-7-11-21(12-8-15)17-9-13-22(14-10-17)19(23)20-16-3-5-18(24-2)6-4-16/h3-6,15,17H,7-14H2,1-2H3,(H,20,23)
InChIKeyJPRVMRDFEUMYCB-UHFFFAOYSA-N
MW331.46 g/mol
LogP3.42
Rot. Bonds3

About N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide

N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide (PubChem CID 146666591) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide
PubChem CID146666591
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC NameN-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(N3CCC(C)CC3)CC2)cc1
InChIInChI=1S/C19H29N3O2/c1-15-7-11-21(12-8-15)17-9-13-22(14-10-17)19(23)20-16-3-5-18(24-2)6-4-16/h3-6,15,17H,7-14H2,1-2H3,(H,20,23)
InChIKeyJPRVMRDFEUMYCB-UHFFFAOYSA-N
XLogP3.42
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Trifluoromethoxyphenyl-3-(1-propionylpiperidine-4-yl)urea
CID 44142782
Difenoxuron
CID 26576
EC-5026
CID 91933845
1-Piperidinecarboxamide, N-(4-methoxyphenyl)-
CID 200753
1-Cyclohexyl-3-(4-methoxy-phenyl)-urea
CID 3397178
N,N'-(Di-p-methoxyphenyl)urea
CID 136951
1-(4-(3-Morpholinopropoxy)phenyl)-3-phenylurea
CID 25014697
3-(1-Acetylpiperidin-4-yl)-1-[4-(trifluoromethoxy)phenyl]urea
CID 25093352
1-Cyclohexyl-3-[4-(trifluoromethoxy)phenyl]urea
CID 4799088
1-{(1R,2S)-2-[(S)-3-(4-Fluoro-benzyl)-piperidin-1-ylmethyl]-cyclohexyl}-3-(4-methoxy-phenyl)-urea
CID 11363006
1-(1-(Cyclopropanecarbonyl)piperidin-4-yl)-3-(4-(trifluoromethoxy)phenyl)urea
CID 45888834
1-(1-((4-Acetylpiperazin-1-yl)acetyl)piperidin-4-yl)-3-(4-(trifluoromethoxy)phenyl)urea
CID 49780366

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide (CID 146666591) is N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide is COc1ccc(NC(=O)N2CCC(N3CCC(C)CC3)CC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide?
The InChIKey is JPRVMRDFEUMYCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-15-7-11-21(12-8-15)17-9-13-22(14-10-17)19(23)20-16-3-5-18(24-2)6-4-16/h3-6,15,17H,7-14H2,1-2H3,(H,20,23).
What are the key properties of N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide?
N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide has a molecular weight of 331.46 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)piperidine-1-carboxamide is sourced from PubChem (CID 146666591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).