2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide

C10H14Cl2N4O — CID 102756840

IUPAC2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide
SMILESCNC(=O)C(C)Nc1nc(NC)c(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N4O/c1-5(10(17)14-3)15-9-7(12)4-6(11)8(13-2)16-9/h4-5H,1-3H3,(H,14,17)(H2,13,15,16)
InChIKeyNCAONISXKGIVII-UHFFFAOYSA-N
MW277.16 g/mol
LogP1.98
Rot. Bonds4

About 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide

2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide (PubChem CID 102756840) has the molecular formula C10H14Cl2N4O and a molecular weight of 277.16 g/mol. Its IUPAC name is 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide.

Molecular Properties

Compound Name2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide
PubChem CID102756840
Molecular FormulaC10H14Cl2N4O
Molecular Weight277.16 g/mol
Exact Mass276.05
IUPAC Name2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide
SMILESCNC(=O)C(C)Nc1nc(NC)c(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N4O/c1-5(10(17)14-3)15-9-7(12)4-6(11)8(13-2)16-9/h4-5H,1-3H3,(H,14,17)(H2,13,15,16)
InChIKeyNCAONISXKGIVII-UHFFFAOYSA-N
XLogP1.98
TPSA66.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.16
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide?
The IUPAC name of 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide (CID 102756840) is 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide.
What is the SMILES notation for 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide?
The canonical SMILES for 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide is CNC(=O)C(C)Nc1nc(NC)c(Cl)cc1Cl.
What is the InChIKey of 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide?
The InChIKey is NCAONISXKGIVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N4O/c1-5(10(17)14-3)15-9-7(12)4-6(11)8(13-2)16-9/h4-5H,1-3H3,(H,14,17)(H2,13,15,16).
What are the key properties of 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide?
2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide has a molecular weight of 277.16 g/mol, XLogP of 1.98, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-N-methylpropanamide is sourced from PubChem (CID 102756840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).