1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide

C21H24ClN3O — CID 38956071

IUPAC1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc2c1CCCC2)C1CCN(c2ccc(Cl)cn2)CC1
InChIInChI=1S/C21H24ClN3O/c22-17-8-9-20(23-14-17)25-12-10-16(11-13-25)21(26)24-19-7-3-5-15-4-1-2-6-18(15)19/h3,5,7-9,14,16H,1-2,4,6,10-13H2,(H,24,26)
InChIKeyUCLFKTQBDASICI-UHFFFAOYSA-N
MW369.90 g/mol
LogP4.47
Rot. Bonds3

About 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide

1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide (PubChem CID 38956071) has the molecular formula C21H24ClN3O and a molecular weight of 369.90 g/mol. Its IUPAC name is 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
PubChem CID38956071
Molecular FormulaC21H24ClN3O
Molecular Weight369.90 g/mol
Exact Mass369.16
IUPAC Name1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc2c1CCCC2)C1CCN(c2ccc(Cl)cn2)CC1
InChIInChI=1S/C21H24ClN3O/c22-17-8-9-20(23-14-17)25-12-10-16(11-13-25)21(26)24-19-7-3-5-15-4-1-2-6-18(15)19/h3,5,7-9,14,16H,1-2,4,6,10-13H2,(H,24,26)
InChIKeyUCLFKTQBDASICI-UHFFFAOYSA-N
XLogP4.47
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.90
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-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

N-(2-chlorophenyl)-1-(5-chloro-2-pyridinyl)piperidine-4-carboxamide
CID 38952409
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-(5-chloro-2-pyridinyl)piperidine-4-carboxamide
CID 55687880
1-(5-chloro-2-pyridinyl)-N-(4-chloro-2-pyrrol-1-ylphenyl)piperidine-4-carboxamide
CID 56582300
1-(5-chloro-2-pyridinyl)-N-(4-hydroxyphenyl)piperidine-4-carboxamide
CID 71935267
1-[1-(5-chloro-2-pyridinyl)piperidine-4-carbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 39466788
1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide
CID 46597156
1-(5-chloro-2-pyridinyl)piperidine-4-carboxylic acid
CID 16787048
N-[(4-chlorophenyl)methyl]-1-(5-chloro-2-pyridinyl)piperidine-4-carboxamide
CID 39705993
1-(5-chloro-2-pyridinyl)-N-(2-methyl-4-propan-2-yloxyphenyl)piperidine-4-carboxamide
CID 55887177
methyl 3-[[1-(5-chloro-2-pyridinyl)piperidine-4-carbonyl]amino]thiophene-2-carboxylate
CID 38967933
1-(5-chloro-2-pyridinyl)-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 55687937
1-(2,5-difluorophenyl)sulfonyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
CID 46536758

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide (CID 38956071) is 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide is O=C(Nc1cccc2c1CCCC2)C1CCN(c2ccc(Cl)cn2)CC1.
What is the InChIKey of 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
The InChIKey is UCLFKTQBDASICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O/c22-17-8-9-20(23-14-17)25-12-10-16(11-13-25)21(26)24-19-7-3-5-15-4-1-2-6-18(15)19/h3,5,7-9,14,16H,1-2,4,6,10-13H2,(H,24,26).
What are the key properties of 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide has a molecular weight of 369.90 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-pyridinyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide is sourced from PubChem (CID 38956071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).