[2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone

C19H24N4O — CID 110094495

IUPAC[2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone
SMILESCNc1cccc(CCC2CCCCN2C(=O)c2cccnc2)n1
InChIInChI=1S/C19H24N4O/c1-20-18-9-4-7-16(22-18)10-11-17-8-2-3-13-23(17)19(24)15-6-5-12-21-14-15/h4-7,9,12,14,17H,2-3,8,10-11,13H2,1H3,(H,20,22)
InChIKeyHUNUDGLVCUBMHQ-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.15
Rot. Bonds5

About [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone

[2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone (PubChem CID 110094495) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone.

Molecular Properties

Compound Name[2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone
PubChem CID110094495
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name[2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone
SMILESCNc1cccc(CCC2CCCCN2C(=O)c2cccnc2)n1
InChIInChI=1S/C19H24N4O/c1-20-18-9-4-7-16(22-18)10-11-17-8-2-3-13-23(17)19(24)15-6-5-12-21-14-15/h4-7,9,12,14,17H,2-3,8,10-11,13H2,1H3,(H,20,22)
InChIKeyHUNUDGLVCUBMHQ-UHFFFAOYSA-N
XLogP3.15
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-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

1-[1-(pyridine-3-carbonyl)piperidin-2-yl]propan-2-one
CID 79548958
3-[1-(pyridine-3-carbonyl)piperidin-2-yl]propanoic acid
CID 62215598
N-[2-[1-(pyridine-3-carbonyl)pyrrolidin-2-yl]ethyl]acetamide
CID 127245085
[2-(2-hydroxypropyl)piperidin-1-yl]-pyridin-3-ylmethanone
CID 79549270
N-[2-[1-(pyridine-3-carbonyl)pyrrolidin-2-yl]ethyl]methanesulfonamide
CID 127245086
[2-[2-(2-methyl-4-pyridinyl)ethyl]pyrrolidin-1-yl]-pyridin-3-ylmethanone
CID 110103609
(2S)-N,N-dimethyl-2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidine-1-sulfonamide
CID 125021160
[2-[2-(methylamino)ethyl]piperidin-1-yl]-pyridazin-4-ylmethanone
CID 113439400
[6-(methylamino)-3-pyridinyl]-(2-propylpiperidin-1-yl)methanone
CID 83061594
2-[1-(pyridine-3-carbonyl)pyrrolidin-2-yl]acetic acid
CID 61371830
1-[(4aR,9aR)-1-(pyridine-3-carbonyl)-3,4,4a,6,7,8,9,9a-octahydro-2H-pyrido[3,2-b]azepin-5-yl]ethanone
CID 110145133
methyl 1-(pyridine-3-carbonyl)piperidine-2-carboxylate
CID 115280040

Frequently Asked Questions

What is the IUPAC name of [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone?
The IUPAC name of [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone (CID 110094495) is [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone.
What is the SMILES notation for [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone?
The canonical SMILES for [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone is CNc1cccc(CCC2CCCCN2C(=O)c2cccnc2)n1.
What is the InChIKey of [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone?
The InChIKey is HUNUDGLVCUBMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-20-18-9-4-7-16(22-18)10-11-17-8-2-3-13-23(17)19(24)15-6-5-12-21-14-15/h4-7,9,12,14,17H,2-3,8,10-11,13H2,1H3,(H,20,22).
What are the key properties of [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone?
[2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone has a molecular weight of 324.43 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[6-(methylamino)-2-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone is sourced from PubChem (CID 110094495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).