2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide

C13H19ClN4O — CID 62155383

IUPAC2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
SMILESCN1CCC(N(C)C(=O)c2cc(N)nc(Cl)c2)CC1
InChIInChI=1S/C13H19ClN4O/c1-17-5-3-10(4-6-17)18(2)13(19)9-7-11(14)16-12(15)8-9/h7-8,10H,3-6H2,1-2H3,(H2,15,16)
InChIKeyMCKBDYIOBPTFFB-UHFFFAOYSA-N
MW282.77 g/mol
LogP1.48
Rot. Bonds2

About 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide

2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide (PubChem CID 62155383) has the molecular formula C13H19ClN4O and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
PubChem CID62155383
Molecular FormulaC13H19ClN4O
Molecular Weight282.77 g/mol
Exact Mass282.12
IUPAC Name2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
SMILESCN1CCC(N(C)C(=O)c2cc(N)nc(Cl)c2)CC1
InChIInChI=1S/C13H19ClN4O/c1-17-5-3-10(4-6-17)18(2)13(19)9-7-11(14)16-12(15)8-9/h7-8,10H,3-6H2,1-2H3,(H2,15,16)
InChIKeyMCKBDYIOBPTFFB-UHFFFAOYSA-N
XLogP1.48
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

4-amino-3,5-dichloro-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 82833409
2,6-dichloro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 61044792
2,6-dichloro-N-cyclohexyl-N-methylpyridine-4-carboxamide
CID 43235774
2-chloro-N-cyclopropyl-6-hydrazinyl-N-methylpyridine-4-carboxamide
CID 62243916
3,5-dibromo-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 113349444
3-amino-5-methoxy-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 81089849
3,4-dihydroxy-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 103955316
2,6-dichloro-N-(1,1-dioxothiolan-3-yl)-N-methylpyridine-4-carboxamide
CID 43410879
2-chloro-N-methyl-6-(methylamino)-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
CID 62542296
4-(chloromethyl)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43333302
2-amino-6-chloro-N-(cyclopropylmethyl)-N-propylpyridine-4-carboxamide
CID 55041470
N-methyl-N-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-indene-5-carboxamide
CID 39902838

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide (CID 62155383) is 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide is CN1CCC(N(C)C(=O)c2cc(N)nc(Cl)c2)CC1.
What is the InChIKey of 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
The InChIKey is MCKBDYIOBPTFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN4O/c1-17-5-3-10(4-6-17)18(2)13(19)9-7-11(14)16-12(15)8-9/h7-8,10H,3-6H2,1-2H3,(H2,15,16).
What are the key properties of 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide is sourced from PubChem (CID 62155383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).