N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide

C25H28N2O2 — CID 23723659

IUPACN-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide
SMILESCOc1ccccc1CN1CCCC(CNC(=O)c2cccc3ccccc23)C1
InChIInChI=1S/C25H28N2O2/c1-29-24-14-5-3-10-21(24)18-27-15-7-8-19(17-27)16-26-25(28)23-13-6-11-20-9-2-4-12-22(20)23/h2-6,9-14,19H,7-8,15-18H2,1H3,(H,26,28)
InChIKeyPUPZGSZJMPCGRY-UHFFFAOYSA-N
MW388.51 g/mol
LogP4.49
Rot. Bonds6

About N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide

N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide (PubChem CID 23723659) has the molecular formula C25H28N2O2 and a molecular weight of 388.51 g/mol. Its IUPAC name is N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide
PubChem CID23723659
Molecular FormulaC25H28N2O2
Molecular Weight388.51 g/mol
Exact Mass388.22
IUPAC NameN-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide
SMILESCOc1ccccc1CN1CCCC(CNC(=O)c2cccc3ccccc23)C1
InChIInChI=1S/C25H28N2O2/c1-29-24-14-5-3-10-21(24)18-27-15-7-8-19(17-27)16-26-25(28)23-13-6-11-20-9-2-4-12-22(20)23/h2-6,9-14,19H,7-8,15-18H2,1H3,(H,26,28)
InChIKeyPUPZGSZJMPCGRY-UHFFFAOYSA-N
XLogP4.49
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.51
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Benzamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071639
2-{2-[3-(Piperazin-1-ylcarbonyl)phenyl]ethoxy}benzamide
CID 25218489
2-Methoxy-N-(3-methyl-2-phenyl-butyl)-benzamide
CID 44270882
N,N-Diethyl-4-[(2-methoxy-phenyl)-piperidin-4-ylidene-methyl]-benzamide
CID 10809678
N-[2-(7-methoxy-3-benzoylnaphth-1-yl)ethyl]acetamide
CID 15289276
(R)-N,N-diethyl-4-(spiro[chroman-2,4''-piperidine]-4-yl)benzamide
CID 44254057
Isoindolin-2-yl(4-(spiro[chromene-2,4''-piperidine]-4-yl)phenyl)methanone
CID 44254956
N-[2-(3-(3-Formylphenyl)-7-methoxynaphth-1-yl)ethyl]acetamide
CID 44579259
10-(cyclopropylmethyl)-N-[2-[4-(4-methoxy-3-methylphenyl)phenyl]ethyl]-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-triene-4-carboxamide
CID 58443217
N-hydroxy-2-[(E)-3-(4-methoxyphenyl)-2-phenylprop-2-enoyl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
CID 60198648
[4-(2-Methoxyphenyl)piperidin-1-yl]-phenylmethanone
CID 2802386
2-(4-methoxybenzyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
CID 2939282

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide?
The IUPAC name of N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide (CID 23723659) is N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide is COc1ccccc1CN1CCCC(CNC(=O)c2cccc3ccccc23)C1.
What is the InChIKey of N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide?
The InChIKey is PUPZGSZJMPCGRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O2/c1-29-24-14-5-3-10-21(24)18-27-15-7-8-19(17-27)16-26-25(28)23-13-6-11-20-9-2-4-12-22(20)23/h2-6,9-14,19H,7-8,15-18H2,1H3,(H,26,28).
What are the key properties of N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide?
N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide has a molecular weight of 388.51 g/mol, XLogP of 4.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(2-methoxyphenyl)methyl]piperidin-3-yl]methyl]naphthalene-1-carboxamide is sourced from PubChem (CID 23723659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).