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

C13H19N3O — CID 62330069

IUPAC(4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2cc(N)ccn2)C(C)C1
InChIInChI=1S/C13H19N3O/c1-9-4-6-16(10(2)7-9)13(17)12-8-11(14)3-5-15-12/h3,5,8-10H,4,6-7H2,1-2H3,(H2,14,15)
InChIKeyFVMPCQXMGCMDLU-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.92
Rot. Bonds1

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

(4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone (PubChem CID 62330069) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
PubChem CID62330069
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name(4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2cc(N)ccn2)C(C)C1
InChIInChI=1S/C13H19N3O/c1-9-4-6-16(10(2)7-9)13(17)12-8-11(14)3-5-15-12/h3,5,8-10H,4,6-7H2,1-2H3,(H2,14,15)
InChIKeyFVMPCQXMGCMDLU-UHFFFAOYSA-N
XLogP1.92
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-amino-2-pyridinyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone
CID 114221525
(4-amino-2-methylphenyl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 62332096
(6-amino-2-pyridinyl)-[(2S,4S)-2,4-dimethylpiperidin-1-yl]methanone
CID 94400305
(4-amino-3-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 81240937
(6-amino-3-chloro-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 62329720
(4-amino-2-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 62154675
(5-amino-2,3-dichlorophenyl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 107185001
[(2R,4R)-2,4-dimethylpiperidin-1-yl]-[2-(ethylamino)-1,3-thiazol-4-yl]methanone
CID 136582996
4-amino-N-(2-methylcyclopropyl)pyridine-2-carboxamide
CID 62410186
[(2R,4R)-2,4-dimethylpiperidin-1-yl]-(1H-pyrrolo[2,3-b]pyridin-4-yl)methanone
CID 166268751
(4-amino-1-ethylpyrrol-2-yl)-(2,4-dimethylpiperidin-1-yl)methanone
CID 62347311
4-aminopyridine-2-carboxylic acid;ethane
CID 91192468

Frequently Asked Questions

What is the IUPAC name of (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
The IUPAC name of (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone (CID 62330069) is (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
The canonical SMILES for (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone is CC1CCN(C(=O)c2cc(N)ccn2)C(C)C1.
What is the InChIKey of (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
The InChIKey is FVMPCQXMGCMDLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-4-6-16(10(2)7-9)13(17)12-8-11(14)3-5-15-12/h3,5,8-10H,4,6-7H2,1-2H3,(H2,14,15).
What are the key properties of (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone?
(4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone has a molecular weight of 233.31 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-2-pyridinyl)-(2,4-dimethylpiperidin-1-yl)methanone is sourced from PubChem (CID 62330069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).