N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide

C22H29N3O — CID 113030633

IUPACN-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(N2CCC(Cc3ccccc3)CC2)cn1
InChIInChI=1S/C22H29N3O/c1-2-3-9-22(26)24-21-11-10-20(17-23-21)25-14-12-19(13-15-25)16-18-7-5-4-6-8-18/h4-8,10-11,17,19H,2-3,9,12-16H2,1H3,(H,23,24,26)
InChIKeyNFXAXMKCKMSLFD-UHFFFAOYSA-N
MW351.49 g/mol
LogP4.67
Rot. Bonds7

About N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide

N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide (PubChem CID 113030633) has the molecular formula C22H29N3O and a molecular weight of 351.49 g/mol. Its IUPAC name is N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide.

Molecular Properties

Compound NameN-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide
PubChem CID113030633
Molecular FormulaC22H29N3O
Molecular Weight351.49 g/mol
Exact Mass351.23
IUPAC NameN-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(N2CCC(Cc3ccccc3)CC2)cn1
InChIInChI=1S/C22H29N3O/c1-2-3-9-22(26)24-21-11-10-20(17-23-21)25-14-12-19(13-15-25)16-18-7-5-4-6-8-18/h4-8,10-11,17,19H,2-3,9,12-16H2,1H3,(H,23,24,26)
InChIKeyNFXAXMKCKMSLFD-UHFFFAOYSA-N
XLogP4.67
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.49
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]-3-methylbutanamide
CID 113030634
N-[4-(4-benzylpiperidin-1-yl)phenyl]butanamide
CID 112985401
N-[5-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]pentanamide
CID 113029615
5-(4-benzylpiperidin-1-yl)-N-butylpyridine-2-carboxamide
CID 109180700
4-amino-N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]butanamide
CID 82034911
4-[[5-(4-methylpiperidin-1-yl)-2-pyridinyl]amino]-4-oxobutanoic acid
CID 39187652
1-[6-(3-aminopropanoylamino)-3-pyridinyl]piperidine-4-carboxylic acid
CID 39187771
4-(2-ethoxyphenoxy)-N-(5-pyrrolidin-1-yl-2-pyridinyl)butanamide
CID 32948152
5-(4-benzylpiperidin-1-yl)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184262
4-(4-benzylpiperidin-1-yl)benzoic acid
CID 22730857
2-(4-benzylpiperidin-1-yl)-N-cyclopropyl-5-(decanoylamino)benzamide
CID 4012959
1-[4-(4-benzylpiperidin-1-yl)phenyl]ethanone
CID 39402702

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide?
The IUPAC name of N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide (CID 113030633) is N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide.
What is the SMILES notation for N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide?
The canonical SMILES for N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide is CCCCC(=O)Nc1ccc(N2CCC(Cc3ccccc3)CC2)cn1.
What is the InChIKey of N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide?
The InChIKey is NFXAXMKCKMSLFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O/c1-2-3-9-22(26)24-21-11-10-20(17-23-21)25-14-12-19(13-15-25)16-18-7-5-4-6-8-18/h4-8,10-11,17,19H,2-3,9,12-16H2,1H3,(H,23,24,26).
What are the key properties of N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide?
N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide has a molecular weight of 351.49 g/mol, XLogP of 4.67, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-benzylpiperidin-1-yl)-2-pyridinyl]pentanamide is sourced from PubChem (CID 113030633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).