4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide

C15H25N5O — CID 63266338

IUPAC4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide
SMILESCc1cc(C)c(C(N)=O)c(N(C)CCN2CCNCC2)n1
InChIInChI=1S/C15H25N5O/c1-11-10-12(2)18-15(13(11)14(16)21)19(3)8-9-20-6-4-17-5-7-20/h10,17H,4-9H2,1-3H3,(H2,16,21)
InChIKeyIBLCSNZDIVZQAZ-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.14
Rot. Bonds5

About 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide

4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide (PubChem CID 63266338) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide
PubChem CID63266338
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide
SMILESCc1cc(C)c(C(N)=O)c(N(C)CCN2CCNCC2)n1
InChIInChI=1S/C15H25N5O/c1-11-10-12(2)18-15(13(11)14(16)21)19(3)8-9-20-6-4-17-5-7-20/h10,17H,4-9H2,1-3H3,(H2,16,21)
InChIKeyIBLCSNZDIVZQAZ-UHFFFAOYSA-N
XLogP0.14
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2-((3-Methylbutyl)amino)-3-pyridinyl)(4-(phenylmethyl)-1-piperazinyl)methanone
CID 50922681
Dipyridodiazepinone deriv. 5
CID 463543
5-{[(1R,2S)-2-aminocyclohexyl]amino}-3-[(4,6-dimethylpyridin-2-yl)amino]pyridine-2-carboxamide
CID 71533675
5-[[(1-Aminocyclopropyl)methyl]amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]-2-pyridinecarboxamide
CID 90355303
2-(4-Ethyl-phenylamino)-4,6-dimethyl-nicotinamide
CID 712047
5,7-dimethylpyrido[2,3-d]pyrimidin-4(3H)-one
CID 135408240
N-ethyl-2-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 3040782
2-(Piperazin-1-yl)pyridine-3-carboxamide
CID 16785637
2-Amino-4,6-dimethylpyridine-3-carboxamide
CID 252216
2,3-Dimethyl-N11-ethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453340
1,8-Naphthyridin-4-ol, 7-methyl-2-propyl-
CID 13155595
2-[4-(tert-butylcarbamoyl)anilino]-6-[(3S)-3-(prop-2-enoylamino)pyrrolidin-1-yl]pyridine-3-carboxamide
CID 137349435

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide?
The IUPAC name of 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide (CID 63266338) is 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide is Cc1cc(C)c(C(N)=O)c(N(C)CCN2CCNCC2)n1.
What is the InChIKey of 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide?
The InChIKey is IBLCSNZDIVZQAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-11-10-12(2)18-15(13(11)14(16)21)19(3)8-9-20-6-4-17-5-7-20/h10,17H,4-9H2,1-3H3,(H2,16,21).
What are the key properties of 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide?
4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 0.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 63266338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).