N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide

C20H25N3O2 — CID 120616741

IUPACN-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)Nc2ccc(Nc3ccccc3)cc2)CCNCC1
InChIInChI=1S/C20H25N3O2/c1-25-15-20(11-13-21-14-12-20)19(24)23-18-9-7-17(8-10-18)22-16-5-3-2-4-6-16/h2-10,21-22H,11-15H2,1H3,(H,23,24)
InChIKeyOIGMFPHBSCQSCX-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.38
Rot. Bonds6

About N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide

N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120616741) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120616741
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)Nc2ccc(Nc3ccccc3)cc2)CCNCC1
InChIInChI=1S/C20H25N3O2/c1-25-15-20(11-13-21-14-12-20)19(24)23-18-9-7-17(8-10-18)22-16-5-3-2-4-6-16/h2-10,21-22H,11-15H2,1H3,(H,23,24)
InChIKeyOIGMFPHBSCQSCX-UHFFFAOYSA-N
XLogP3.38
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120622758
N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120624225
N-[4-(2-amino-2-oxoethyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120620858
N-(3-anilino-3-oxopropyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120632986
4-(methoxymethyl)-N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-4-carboxamide
CID 120626064
N-[4-(dimethylcarbamoyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120617739
4-(methoxymethyl)-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide
CID 120619785
N-[4-(ethylcarbamoyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120621167
[4-[[4-(methoxymethyl)piperidine-4-carbonyl]amino]phenyl] N,N-dimethylcarbamate
CID 175264615
4-(methoxymethyl)-N-[4-(triazol-2-yl)phenyl]piperidine-4-carboxamide
CID 120623718
4-(methoxymethyl)-N-[3-(methylcarbamoylamino)phenyl]piperidine-4-carboxamide;hydrochloride
CID 120619753
N-[4-(4-ethoxyphenoxy)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120617171

Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide (CID 120616741) is N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide is COCC1(C(=O)Nc2ccc(Nc3ccccc3)cc2)CCNCC1.
What is the InChIKey of N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is OIGMFPHBSCQSCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-25-15-20(11-13-21-14-12-20)19(24)23-18-9-7-17(8-10-18)22-16-5-3-2-4-6-16/h2-10,21-22H,11-15H2,1H3,(H,23,24).
What are the key properties of N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide?
N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.38, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120616741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).