N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide

C15H20N2O3 — CID 106911956

IUPACN-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1cccc(C2OCCO2)c1)C1CCCCN1
InChIInChI=1S/C15H20N2O3/c18-14(13-6-1-2-7-16-13)17-12-5-3-4-11(10-12)15-19-8-9-20-15/h3-5,10,13,15-16H,1-2,6-9H2,(H,17,18)
InChIKeyZLFPYXYQPYSUKW-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.81
Rot. Bonds3

About N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide

N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide (PubChem CID 106911956) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide
PubChem CID106911956
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1cccc(C2OCCO2)c1)C1CCCCN1
InChIInChI=1S/C15H20N2O3/c18-14(13-6-1-2-7-16-13)17-12-5-3-4-11(10-12)15-19-8-9-20-15/h3-5,10,13,15-16H,1-2,6-9H2,(H,17,18)
InChIKeyZLFPYXYQPYSUKW-UHFFFAOYSA-N
XLogP1.81
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-bromophenyl)piperidine-2-carboxamide
CID 18073202
N-[3-(1,3-dioxolan-2-yl)phenyl]pyrrolidine-3-carboxamide
CID 106911880
(2R)-N-(3-chlorophenyl)piperidine-2-carboxamide;hydrochloride
CID 119671014
3-[[(2R)-piperidine-2-carbonyl]amino]benzoic acid
CID 104913517
N-(3-aminophenyl)pyrrolidine-2-carboxamide
CID 110481304
3-(azepane-2-carbonylamino)benzoic acid
CID 64563826
N-[3-(2-methylpropanoylamino)phenyl]piperidine-2-carboxamide
CID 43710007
methyl N-[3-[[(2S)-piperidine-2-carbonyl]amino]phenyl]carbamate
CID 103809256
(2S)-N-phenylpiperidine-2-carboxamide;hydrochloride
CID 68574355
N-[3-(1,3-dithiolan-2-yl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119272597
N-[3-(2-methylpropanoylamino)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119281759
N-[3-(hydroxymethyl)phenyl]azepane-2-carboxamide
CID 64561657

Frequently Asked Questions

What is the IUPAC name of N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide?
The IUPAC name of N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide (CID 106911956) is N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide?
The canonical SMILES for N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide is O=C(Nc1cccc(C2OCCO2)c1)C1CCCCN1.
What is the InChIKey of N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide?
The InChIKey is ZLFPYXYQPYSUKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c18-14(13-6-1-2-7-16-13)17-12-5-3-4-11(10-12)15-19-8-9-20-15/h3-5,10,13,15-16H,1-2,6-9H2,(H,17,18).
What are the key properties of N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide?
N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1,3-dioxolan-2-yl)phenyl]piperidine-2-carboxamide is sourced from PubChem (CID 106911956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).