8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine

C17H18N4O — CID 121389384

IUPAC8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine
SMILESCc1cc2cnn(C)c2cc1-c1cncc2c1COCC2N
InChIInChI=1S/C17H18N4O/c1-10-3-11-5-20-21(2)17(11)4-12(10)13-6-19-7-14-15(13)8-22-9-16(14)18/h3-7,16H,8-9,18H2,1-2H3
InChIKeyKRXAWPAMYZSSLJ-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.47
Rot. Bonds1

About 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine

8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine (PubChem CID 121389384) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine.

Molecular Properties

Compound Name8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine
PubChem CID121389384
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC Name8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine
SMILESCc1cc2cnn(C)c2cc1-c1cncc2c1COCC2N
InChIInChI=1S/C17H18N4O/c1-10-3-11-5-20-21(2)17(11)4-12(10)13-6-19-7-14-15(13)8-22-9-16(14)18/h3-7,16H,8-9,18H2,1-2H3
InChIKeyKRXAWPAMYZSSLJ-UHFFFAOYSA-N
XLogP2.47
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine?
The IUPAC name of 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine (CID 121389384) is 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine.
What is the SMILES notation for 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine?
The canonical SMILES for 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine is Cc1cc2cnn(C)c2cc1-c1cncc2c1COCC2N.
What is the InChIKey of 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine?
The InChIKey is KRXAWPAMYZSSLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O/c1-10-3-11-5-20-21(2)17(11)4-12(10)13-6-19-7-14-15(13)8-22-9-16(14)18/h3-7,16H,8-9,18H2,1-2H3.
What are the key properties of 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine?
8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine has a molecular weight of 294.36 g/mol, XLogP of 2.47, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1,5-dimethylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-amine is sourced from PubChem (CID 121389384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).