(6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone

C13H18ClN3O — CID 62329720

IUPAC(6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2nc(N)ccc2Cl)C(C)C1
InChIInChI=1S/C13H18ClN3O/c1-8-5-6-17(9(2)7-8)13(18)12-10(14)3-4-11(15)16-12/h3-4,8-9H,5-7H2,1-2H3,(H2,15,16)
InChIKeyRTRDKBGSIHNQQD-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.58
Rot. Bonds1

About (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone

(6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone (PubChem CID 62329720) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
PubChem CID62329720
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name(6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2nc(N)ccc2Cl)C(C)C1
InChIInChI=1S/C13H18ClN3O/c1-8-5-6-17(9(2)7-8)13(18)12-10(14)3-4-11(15)16-12/h3-4,8-9H,5-7H2,1-2H3,(H2,15,16)
InChIKeyRTRDKBGSIHNQQD-UHFFFAOYSA-N
XLogP2.58
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone 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

(6-amino-2-pyridinyl)-[(2S,4S)-2,4-dimethylpiperidin-1-yl]methanone
CID 94400305
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(6-amino-3-chloro-2-pyridinyl)methanone
CID 82752072
6-amino-3-chloro-N-methyl-N-(3-methylcyclohexyl)pyridine-2-carboxamide
CID 62159524
6-amino-3-chloro-N-(3-methylcyclopentyl)pyridine-2-carboxamide
CID 114540527
2-chloro-5-(2,4-dimethylpiperidine-1-carbonyl)benzenesulfonamide
CID 65387685
(6-amino-3-chloro-2-pyridinyl)-(4-ethylpiperidin-1-yl)methanone
CID 55041866
(5-amino-2,3-dichlorophenyl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 107185001
(4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 62330069
(6-amino-3-chloro-2-pyridinyl)-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 63768979
(6-amino-3-chloro-2-pyridinyl)-(3,4-dihydroxypyrrolidin-1-yl)methanone
CID 106673826
5-chloro-6-[(2,4-dimethylpiperidin-1-yl)methyl]pyridin-2-amine
CID 62892563
(5,6-dichloro-3-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 62330677

Frequently Asked Questions

What is the IUPAC name of (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
The IUPAC name of (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone (CID 62329720) is (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone.
What is the SMILES notation for (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
The canonical SMILES for (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone is CC1CCN(C(=O)c2nc(N)ccc2Cl)C(C)C1.
What is the InChIKey of (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
The InChIKey is RTRDKBGSIHNQQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c1-8-5-6-17(9(2)7-8)13(18)12-10(14)3-4-11(15)16-12/h3-4,8-9H,5-7H2,1-2H3,(H2,15,16).
What are the key properties of (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
(6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone has a molecular weight of 267.76 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone is sourced from PubChem (CID 62329720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).