1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine

C15H16N4 — CID 63772569

IUPAC1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine
SMILESCNCc1cnc2c(cnn2Cc2ccccc2)c1
InChIInChI=1S/C15H16N4/c1-16-8-13-7-14-10-18-19(15(14)17-9-13)11-12-5-3-2-4-6-12/h2-7,9-10,16H,8,11H2,1H3
InChIKeyBHBVPTWXHFSSKP-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.20
Rot. Bonds4

About 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine

1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine (PubChem CID 63772569) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine
PubChem CID63772569
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine
SMILESCNCc1cnc2c(cnn2Cc2ccccc2)c1
InChIInChI=1S/C15H16N4/c1-16-8-13-7-14-10-18-19(15(14)17-9-13)11-12-5-3-2-4-6-12/h2-7,9-10,16H,8,11H2,1H3
InChIKeyBHBVPTWXHFSSKP-UHFFFAOYSA-N
XLogP2.20
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine (CID 63772569) is 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine is CNCc1cnc2c(cnn2Cc2ccccc2)c1.
What is the InChIKey of 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine?
The InChIKey is BHBVPTWXHFSSKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-16-8-13-7-14-10-18-19(15(14)17-9-13)11-12-5-3-2-4-6-12/h2-7,9-10,16H,8,11H2,1H3.
What are the key properties of 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine?
1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine has a molecular weight of 252.32 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzylpyrazolo[5,4-b]pyridin-5-yl)-N-methylmethanamine is sourced from PubChem (CID 63772569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).