N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine

C13H21N5 — CID 91486543

IUPACN'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine
SMILESCc1nn(C)c2nc(N(C)CCN(C)C)ccc12
InChIInChI=1S/C13H21N5/c1-10-11-6-7-12(14-13(11)18(5)15-10)17(4)9-8-16(2)3/h6-7H,8-9H2,1-5H3
InChIKeyJVQNKFUZRMULSY-UHFFFAOYSA-N
MW247.35 g/mol
LogP1.27
Rot. Bonds4

About N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine

N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine (PubChem CID 91486543) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine
PubChem CID91486543
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC NameN'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine
SMILESCc1nn(C)c2nc(N(C)CCN(C)C)ccc12
InChIInChI=1S/C13H21N5/c1-10-11-6-7-12(14-13(11)18(5)15-10)17(4)9-8-16(2)3/h6-7H,8-9H2,1-5H3
InChIKeyJVQNKFUZRMULSY-UHFFFAOYSA-N
XLogP1.27
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethane;1,3,6-trimethylpyrazolo[5,4-b]pyridine
CID 177008769
(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)hydrazine
CID 55282105
(1,3,6-trimethylpyrazolo[5,4-b]pyridin-5-yl)methanamine
CID 82504722
1,3,6-trimethylpyrazolo[3,4-d]pyrimidine
CID 58861824
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-N',N'-dimethylethane-1,2-diamine
CID 63032802
N',N'-dimethyl-N-(1,3,7-trimethylpyrazolo[3,4-b]quinolin-4-yl)propane-1,3-diamine;hydrochloride
CID 54606894
N'-(2,6-dimethyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine
CID 142358550
N'-(6-chloropyridazin-3-yl)-N,N,N'-trimethylethane-1,2-diamine
CID 63701006
N-[6-[2-(dimethylamino)ethyl-methylamino]-1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]carbamoyl]formamide;hydrochloride
CID 87918664
2-N-[2-(dimethylamino)ethyl]-6-methoxy-2-N-methyl-5-N-[4-(3-methylindazol-1-yl)pyrimidin-2-yl]pyridine-2,5-diamine
CID 176897131
N-(1,3-dimethylpyrazolo[3,4-b]pyridin-4-yl)-N',N'-dimethylpropane-1,3-diamine
CID 90678705
4-[2-(dimethylamino)ethyl]-1,3-dimethylpyrazolo[5,4-c]isoquinolin-5-one
CID 23332760

Frequently Asked Questions

What is the IUPAC name of N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine?
The IUPAC name of N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine (CID 91486543) is N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine.
What is the SMILES notation for N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine?
The canonical SMILES for N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine is Cc1nn(C)c2nc(N(C)CCN(C)C)ccc12.
What is the InChIKey of N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine?
The InChIKey is JVQNKFUZRMULSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-10-11-6-7-12(14-13(11)18(5)15-10)17(4)9-8-16(2)3/h6-7H,8-9H2,1-5H3.
What are the key properties of N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine?
N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine has a molecular weight of 247.35 g/mol, XLogP of 1.27, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)-N,N,N'-trimethylethane-1,2-diamine is sourced from PubChem (CID 91486543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).