N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide

C29H33N3O3 — CID 42881516

IUPACN-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CCN(C3CCN(C(=O)c4cccc5ccccc45)CC3)CC2)c1
InChIInChI=1S/C29H33N3O3/c1-35-25-9-5-8-23(20-25)30-28(33)22-12-16-31(17-13-22)24-14-18-32(19-15-24)29(34)27-11-4-7-21-6-2-3-10-26(21)27/h2-11,20,22,24H,12-19H2,1H3,(H,30,33)
InChIKeyCXPWHOWXSFNKRC-UHFFFAOYSA-N
MW471.60 g/mol
LogP4.80
Rot. Bonds5

About N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide

N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide (PubChem CID 42881516) has the molecular formula C29H33N3O3 and a molecular weight of 471.60 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide
PubChem CID42881516
Molecular FormulaC29H33N3O3
Molecular Weight471.60 g/mol
Exact Mass471.25
IUPAC NameN-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CCN(C3CCN(C(=O)c4cccc5ccccc45)CC3)CC2)c1
InChIInChI=1S/C29H33N3O3/c1-35-25-9-5-8-23(20-25)30-28(33)22-12-16-31(17-13-22)24-14-18-32(19-15-24)29(34)27-11-4-7-21-6-2-3-10-26(21)27/h2-11,20,22,24H,12-19H2,1H3,(H,30,33)
InChIKeyCXPWHOWXSFNKRC-UHFFFAOYSA-N
XLogP4.80
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.60
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 17019052
1-[1-(2-ethylhexanoyl)piperidin-4-yl]-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 42881514
1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide
CID 27700417
1-(naphthalene-1-carbonyl)-N-(3-sulfamoylphenyl)piperidine-4-carboxamide
CID 27396106
methyl 2-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]benzoate
CID 55430267
N'-[2-(4-methoxyanilino)acetyl]-1-(naphthalene-1-carbonyl)piperidine-4-carbohydrazide
CID 55430041
N-[3-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]phenyl]pyridine-4-carboxamide
CID 55610513
N-[4-(diethylamino)phenyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46581827
1-(3,4-dimethylbenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 113007461
1-(1-acetylpiperidin-4-yl)-N-(4-methoxyphenyl)piperidine-4-carboxamide
CID 42693365
N-(3-chloro-4-piperidin-1-ylphenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55884883
1-[2-(1H-indol-3-yl)acetyl]-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 113007464

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide (CID 42881516) is N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide is COc1cccc(NC(=O)C2CCN(C3CCN(C(=O)c4cccc5ccccc45)CC3)CC2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide?
The InChIKey is CXPWHOWXSFNKRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33N3O3/c1-35-25-9-5-8-23(20-25)30-28(33)22-12-16-31(17-13-22)24-14-18-32(19-15-24)29(34)27-11-4-7-21-6-2-3-10-26(21)27/h2-11,20,22,24H,12-19H2,1H3,(H,30,33).
What are the key properties of N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide?
N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide has a molecular weight of 471.60 g/mol, XLogP of 4.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide is sourced from PubChem (CID 42881516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).