2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

C23H29N3O — CID 77089721

IUPAC2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESO=C(CC1CCNCC1)N(Cc1ccncc1)C1CCCc2ccccc21
InChIInChI=1S/C23H29N3O/c27-23(16-18-8-12-24-13-9-18)26(17-19-10-14-25-15-11-19)22-7-3-5-20-4-1-2-6-21(20)22/h1-2,4,6,10-11,14-15,18,22,24H,3,5,7-9,12-13,16-17H2
InChIKeyUHPANAGCPBWCJD-UHFFFAOYSA-N
MW363.50 g/mol
LogP3.88
Rot. Bonds5

About 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (PubChem CID 77089721) has the molecular formula C23H29N3O and a molecular weight of 363.50 g/mol. Its IUPAC name is 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound Name2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
PubChem CID77089721
Molecular FormulaC23H29N3O
Molecular Weight363.50 g/mol
Exact Mass363.23
IUPAC Name2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESO=C(CC1CCNCC1)N(Cc1ccncc1)C1CCCc2ccccc21
InChIInChI=1S/C23H29N3O/c27-23(16-18-8-12-24-13-9-18)26(17-19-10-14-25-15-11-19)22-7-3-5-20-4-1-2-6-21(20)22/h1-2,4,6,10-11,14-15,18,22,24H,3,5,7-9,12-13,16-17H2
InChIKeyUHPANAGCPBWCJD-UHFFFAOYSA-N
XLogP3.88
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.50
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 42697034
3-(4-bromophenyl)-1-(pyridin-4-ylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
CID 42697000
N-benzyl-N-cyclopropyl-2-piperidin-4-ylacetamide
CID 61030052
N'-benzyl-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)oxamide
CID 169111215
N,N-dibenzyl-2-piperidin-4-ylacetamide
CID 119669950
N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-4-carboxamide
CID 42916496
N-cyclopropyl-3-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
CID 119728180
2-[cyclopropyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N-pyridin-4-ylacetamide
CID 154748560
N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride
CID 119669861
2-[(1R)-2,3-dihydro-1H-inden-1-yl]-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)acetamide
CID 99959246
N-methyl-2-pyridin-3-yl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 96575672
1-methyl-N-(pyridin-3-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-2-carboxamide
CID 131933819

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The IUPAC name of 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (CID 77089721) is 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.
What is the SMILES notation for 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The canonical SMILES for 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is O=C(CC1CCNCC1)N(Cc1ccncc1)C1CCCc2ccccc21.
What is the InChIKey of 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The InChIKey is UHPANAGCPBWCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O/c27-23(16-18-8-12-24-13-9-18)26(17-19-10-14-25-15-11-19)22-7-3-5-20-4-1-2-6-21(20)22/h1-2,4,6,10-11,14-15,18,22,24H,3,5,7-9,12-13,16-17H2.
What are the key properties of 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide has a molecular weight of 363.50 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-N-(pyridin-4-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 77089721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).