1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol

C10H15Cl2N3O — CID 102758667

IUPAC1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol
SMILESCNc1nc(NCC(C)(C)O)c(Cl)cc1Cl
InChIInChI=1S/C10H15Cl2N3O/c1-10(2,16)5-14-9-7(12)4-6(11)8(13-3)15-9/h4,16H,5H2,1-3H3,(H2,13,14,15)
InChIKeySHNRQMNHWFNVJN-UHFFFAOYSA-N
MW264.16 g/mol
LogP2.61
Rot. Bonds4

About 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol

1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol (PubChem CID 102758667) has the molecular formula C10H15Cl2N3O and a molecular weight of 264.16 g/mol. Its IUPAC name is 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol
PubChem CID102758667
Molecular FormulaC10H15Cl2N3O
Molecular Weight264.16 g/mol
Exact Mass263.06
IUPAC Name1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol
SMILESCNc1nc(NCC(C)(C)O)c(Cl)cc1Cl
InChIInChI=1S/C10H15Cl2N3O/c1-10(2,16)5-14-9-7(12)4-6(11)8(13-3)15-9/h4,16H,5H2,1-3H3,(H2,13,14,15)
InChIKeySHNRQMNHWFNVJN-UHFFFAOYSA-N
XLogP2.61
TPSA57.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.16
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol (CID 102758667) is 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol is CNc1nc(NCC(C)(C)O)c(Cl)cc1Cl.
What is the InChIKey of 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol?
The InChIKey is SHNRQMNHWFNVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15Cl2N3O/c1-10(2,16)5-14-9-7(12)4-6(11)8(13-3)15-9/h4,16H,5H2,1-3H3,(H2,13,14,15).
What are the key properties of 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol?
1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol has a molecular weight of 264.16 g/mol, XLogP of 2.61, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]amino]-2-methylpropan-2-ol is sourced from PubChem (CID 102758667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).