N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide

C14H18N2O2 — CID 58761955

IUPACN-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide
SMILESCN1CCC(C(=O)c2ccc(NC=O)cc2)CC1
InChIInChI=1S/C14H18N2O2/c1-16-8-6-12(7-9-16)14(18)11-2-4-13(5-3-11)15-10-17/h2-5,10,12H,6-9H2,1H3,(H,15,17)
InChIKeyXEHWMDSRKFLYSK-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.78
Rot. Bonds4

About N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide

N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide (PubChem CID 58761955) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide.

Molecular Properties

Compound NameN-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide
PubChem CID58761955
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide
SMILESCN1CCC(C(=O)c2ccc(NC=O)cc2)CC1
InChIInChI=1S/C14H18N2O2/c1-16-8-6-12(7-9-16)14(18)11-2-4-13(5-3-11)15-10-17/h2-5,10,12H,6-9H2,1H3,(H,15,17)
InChIKeyXEHWMDSRKFLYSK-UHFFFAOYSA-N
XLogP1.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[4-(4-methylpiperazine-1-carbonyl)phenyl]formamide
CID 58761975
2,2-dimethyl-1-[4-(1-methylpiperidine-4-carbonyl)phenyl]propan-1-one
CID 58228571
N-(4-acetylphenyl)-1-methylpiperidine-4-carboxamide
CID 59145520
N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]formamide
CID 169085664
(4-bromophenyl)-(1-methylpyrrolidin-3-yl)methanone
CID 68951075
[1-(4-methylbenzoyl)piperidin-4-yl]-(4-methylphenyl)methanone
CID 2741000
N-[3-(cyclopropanecarbonyl)phenyl]formamide
CID 146310044
(2S)-2-hydroxy-N-[3-(1-methylpiperidine-4-carbonyl)phenyl]propanamide;(2R)-2-hydroxy-N-[3-(1-methylpiperidine-4-carbonyl)phenyl]propanamide
CID 160998989
1-methyl-3-[3-(1-methylpiperidine-4-carbonyl)phenyl]thiourea
CID 86759511
N-[4-(cyclooctanecarbonyl)phenyl]acetamide
CID 65018343
2-(1-methylpiperidine-4-carbonyl)benzoic acid
CID 116836422
N-[2-(1-methylpiperidine-4-carbonyl)-4-[2-(methylsulfamoyl)ethyl]phenyl]formamide
CID 10737714

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide?
The IUPAC name of N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide (CID 58761955) is N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide.
What is the SMILES notation for N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide?
The canonical SMILES for N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide is CN1CCC(C(=O)c2ccc(NC=O)cc2)CC1.
What is the InChIKey of N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide?
The InChIKey is XEHWMDSRKFLYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-16-8-6-12(7-9-16)14(18)11-2-4-13(5-3-11)15-10-17/h2-5,10,12H,6-9H2,1H3,(H,15,17).
What are the key properties of N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide?
N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide has a molecular weight of 246.31 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-methylpiperidine-4-carbonyl)phenyl]formamide is sourced from PubChem (CID 58761955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).