potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine

C17H20KN3O — CID 158272877

IUPACpotassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine
SMILESCC(C)(C)[O-].[K+].c1ccc(Nn2ccc3ccccc32)nc1
InChIInChI=1S/C13H11N3.C4H9O.K/c1-2-6-12-11(5-1)8-10-16(12)15-13-7-3-4-9-14-13;1-4(2,3)5;/h1-10H,(H,14,15);1-3H3;/q;-1;+1
InChIKeyZXJKRYGESMAHCC-UHFFFAOYSA-N
MW321.47 g/mol
LogP0.06
Rot. Bonds2

About potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine

potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine (PubChem CID 158272877) has the molecular formula C17H20KN3O and a molecular weight of 321.47 g/mol. Its IUPAC name is potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine.

Molecular Properties

Compound Namepotassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine
PubChem CID158272877
Molecular FormulaC17H20KN3O
Molecular Weight321.47 g/mol
Exact Mass321.12
IUPAC Namepotassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine
SMILESCC(C)(C)[O-].[K+].c1ccc(Nn2ccc3ccccc32)nc1
InChIInChI=1S/C13H11N3.C4H9O.K/c1-2-6-12-11(5-1)8-10-16(12)15-13-7-3-4-9-14-13;1-4(2,3)5;/h1-10H,(H,14,15);1-3H3;/q;-1;+1
InChIKeyZXJKRYGESMAHCC-UHFFFAOYSA-N
XLogP0.06
TPSA52.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.47
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-pyridin-2-ylindol-1-amine
CID 22277752
N-(6-chloropyrimidin-4-yl)indol-1-amine
CID 15158243
2-(pyridin-2-ylamino)propan-2-ol
CID 91613794
but-2-enedioic acid;N-pyridin-4-ylindol-1-amine
CID 57346992
N-(3-methylpentan-3-yl)pyridin-2-amine
CID 106329310
potassium N-methanidylpyridin-2-amine
CID 153353371
methanol;N-methylpyridin-2-amine
CID 174971654
2-indol-1-ylpropan-2-amine
CID 68539094
N-(3,3-dimethylbutan-2-yl)pyridin-2-amine
CID 112704501
N-pyridin-2-ylpyridin-2-amine;hydrochloride
CID 517616
4-(indol-1-ylmethyl)-N-methylpyridin-2-amine
CID 141153764
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]pyridin-2-amine
CID 84758728

Frequently Asked Questions

What is the IUPAC name of potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine?
The IUPAC name of potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine (CID 158272877) is potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine.
What is the SMILES notation for potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine?
The canonical SMILES for potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine is CC(C)(C)[O-].[K+].c1ccc(Nn2ccc3ccccc32)nc1.
What is the InChIKey of potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine?
The InChIKey is ZXJKRYGESMAHCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3.C4H9O.K/c1-2-6-12-11(5-1)8-10-16(12)15-13-7-3-4-9-14-13;1-4(2,3)5;/h1-10H,(H,14,15);1-3H3;/q;-1;+1.
What are the key properties of potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine?
potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine has a molecular weight of 321.47 g/mol, XLogP of 0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-methylpropan-2-olate;N-pyridin-2-ylindol-1-amine is sourced from PubChem (CID 158272877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).