7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide

C29H30N2O — CID 18472597

IUPAC7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide
SMILESO=C(Nc1cccc(CN2CCCCC2)c1)C1=Cc2cc(-c3ccccc3)ccc2CC1
InChIInChI=1S/C29H30N2O/c32-29(30-28-11-7-8-22(18-28)21-31-16-5-2-6-17-31)26-15-13-24-12-14-25(19-27(24)20-26)23-9-3-1-4-10-23/h1,3-4,7-12,14,18-20H,2,5-6,13,15-17,21H2,(H,30,32)
InChIKeyHHZYCVCCZZNXIY-UHFFFAOYSA-N
MW422.57 g/mol
LogP6.31
Rot. Bonds5

About 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide

7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide (PubChem CID 18472597) has the molecular formula C29H30N2O and a molecular weight of 422.57 g/mol. Its IUPAC name is 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide.

Molecular Properties

Compound Name7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide
PubChem CID18472597
Molecular FormulaC29H30N2O
Molecular Weight422.57 g/mol
Exact Mass422.24
IUPAC Name7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide
SMILESO=C(Nc1cccc(CN2CCCCC2)c1)C1=Cc2cc(-c3ccccc3)ccc2CC1
InChIInChI=1S/C29H30N2O/c32-29(30-28-11-7-8-22(18-28)21-31-16-5-2-6-17-31)26-15-13-24-12-14-25(19-27(24)20-26)23-9-3-1-4-10-23/h1,3-4,7-12,14,18-20H,2,5-6,13,15-17,21H2,(H,30,32)
InChIKeyHHZYCVCCZZNXIY-UHFFFAOYSA-N
XLogP6.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.57
LogP ≤ 56.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-phenyl-N-[4-(2-piperidin-1-ylethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide
CID 10765394
N-[4-(morpholin-4-ylmethyl)phenyl]-7-phenyl-3,4-dihydronaphthalene-2-carboxamide
CID 10788468
N-[3-(piperidin-1-ylmethyl)phenyl]-2H-chromene-3-carboxamide
CID 34451519
N-[4-[(1-methylazepan-1-ium-1-yl)methyl]phenyl]-7-phenyl-3,4-dihydronaphthalene-2-carboxamide iodide
CID 10650855
3-(4-methylphenyl)-N-[3-(2-piperidin-1-ylethoxy)phenyl]-8,9-dihydro-7H-benzo[7]annulene-6-carboxamide
CID 143836383
7-phenyl-N-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide
CID 18472667
[4-[(7-phenyl-3,4-dihydronaphthalene-2-carbonyl)amino]phenyl]methyl-tripropylazanium chloride
CID 18472230
7-(4-methylphenyl)-N-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]-3,4-dihydronaphthalene-2-carboxamide
CID 18472546
4-piperidin-1-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]benzamide
CID 131945744
3-fluoro-N-[3-(piperidin-1-ylmethyl)phenyl]benzamide
CID 34455176
[4-[(7-phenyl-3,4-dihydronaphthalene-2-carbonyl)amino]phenyl]-tripropylazanium chloride
CID 69353759
N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]-4-phenylbenzamide
CID 44527529

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide?
The IUPAC name of 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide (CID 18472597) is 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide.
What is the SMILES notation for 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide?
The canonical SMILES for 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide is O=C(Nc1cccc(CN2CCCCC2)c1)C1=Cc2cc(-c3ccccc3)ccc2CC1.
What is the InChIKey of 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide?
The InChIKey is HHZYCVCCZZNXIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30N2O/c32-29(30-28-11-7-8-22(18-28)21-31-16-5-2-6-17-31)26-15-13-24-12-14-25(19-27(24)20-26)23-9-3-1-4-10-23/h1,3-4,7-12,14,18-20H,2,5-6,13,15-17,21H2,(H,30,32).
What are the key properties of 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide?
7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide has a molecular weight of 422.57 g/mol, XLogP of 6.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-N-[3-(piperidin-1-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide is sourced from PubChem (CID 18472597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).