N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine

C13H13N5 — CID 126553618

IUPACN,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine
SMILESCN(C)c1cncc(-c2cc3cn[nH]c3cn2)c1
InChIInChI=1S/C13H13N5/c1-18(2)11-3-9(5-14-7-11)12-4-10-6-16-17-13(10)8-15-12/h3-8H,1-2H3,(H,16,17)
InChIKeyTWNICEFJHWRNFB-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.09
Rot. Bonds2

About N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine

N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine (PubChem CID 126553618) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine
PubChem CID126553618
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC NameN,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine
SMILESCN(C)c1cncc(-c2cc3cn[nH]c3cn2)c1
InChIInChI=1S/C13H13N5/c1-18(2)11-3-9(5-14-7-11)12-4-10-6-16-17-13(10)8-15-12/h3-8H,1-2H3,(H,16,17)
InChIKeyTWNICEFJHWRNFB-UHFFFAOYSA-N
XLogP2.09
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine?
The IUPAC name of N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine (CID 126553618) is N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine.
What is the SMILES notation for N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine?
The canonical SMILES for N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine is CN(C)c1cncc(-c2cc3cn[nH]c3cn2)c1.
What is the InChIKey of N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine?
The InChIKey is TWNICEFJHWRNFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c1-18(2)11-3-9(5-14-7-11)12-4-10-6-16-17-13(10)8-15-12/h3-8H,1-2H3,(H,16,17).
What are the key properties of N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine?
N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine has a molecular weight of 239.28 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine is sourced from PubChem (CID 126553618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).