[5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone

C15H23N3O — CID 109181202

IUPAC[5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone
SMILESCC(C)CNc1ccc(C(=O)N2CCCCC2)nc1
InChIInChI=1S/C15H23N3O/c1-12(2)10-16-13-6-7-14(17-11-13)15(19)18-8-4-3-5-9-18/h6-7,11-12,16H,3-5,8-10H2,1-2H3
InChIKeyBZILYMXSKCXWRW-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.78
Rot. Bonds4

About [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone

[5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone (PubChem CID 109181202) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone
PubChem CID109181202
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name[5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone
SMILESCC(C)CNc1ccc(C(=O)N2CCCCC2)nc1
InChIInChI=1S/C15H23N3O/c1-12(2)10-16-13-6-7-14(17-11-13)15(19)18-8-4-3-5-9-18/h6-7,11-12,16H,3-5,8-10H2,1-2H3
InChIKeyBZILYMXSKCXWRW-UHFFFAOYSA-N
XLogP2.78
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone 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

[5-(3-methylbutylamino)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109182598
azocan-1-yl-[5-(ethylamino)-2-pyridinyl]methanone
CID 104639816
[4-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109203044
azepan-1-yl-(5-hydrazinyl-2-pyridinyl)methanone
CID 104642343
[5-(3-methoxypropylamino)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109182537
N-[4-[[6-(piperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
CID 109182665
[5-(ethylamino)-2-pyridinyl]-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 104641158
[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]-piperidin-1-ylmethanone
CID 109182563
[5-(pyridin-4-ylmethylamino)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109181808
piperidin-1-yl-[5-(pyridin-2-ylmethylamino)-2-pyridinyl]methanone
CID 109182557
N-[4-[[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
CID 109181915
[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109182540

Frequently Asked Questions

What is the IUPAC name of [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone?
The IUPAC name of [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone (CID 109181202) is [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone.
What is the SMILES notation for [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone?
The canonical SMILES for [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone is CC(C)CNc1ccc(C(=O)N2CCCCC2)nc1.
What is the InChIKey of [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone?
The InChIKey is BZILYMXSKCXWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12(2)10-16-13-6-7-14(17-11-13)15(19)18-8-4-3-5-9-18/h6-7,11-12,16H,3-5,8-10H2,1-2H3.
What are the key properties of [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone?
[5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone has a molecular weight of 261.37 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methylpropylamino)-2-pyridinyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 109181202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).