N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide

C13H19N5O — CID 120654061

IUPACN-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCCN[C@H](C)CNC(=O)c1cnc2n[nH]c(C)c2c1
InChIInChI=1S/C13H19N5O/c1-4-14-8(2)6-16-13(19)10-5-11-9(3)17-18-12(11)15-7-10/h5,7-8,14H,4,6H2,1-3H3,(H,16,19)(H,15,17,18)/t8-/m1/s1
InChIKeyPETXCHGNAJOTAN-MRVPVSSYSA-N
MW261.33 g/mol
LogP0.99
Rot. Bonds5

About N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide

N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 120654061) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID120654061
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCCN[C@H](C)CNC(=O)c1cnc2n[nH]c(C)c2c1
InChIInChI=1S/C13H19N5O/c1-4-14-8(2)6-16-13(19)10-5-11-9(3)17-18-12(11)15-7-10/h5,7-8,14H,4,6H2,1-3H3,(H,16,19)(H,15,17,18)/t8-/m1/s1
InChIKeyPETXCHGNAJOTAN-MRVPVSSYSA-N
XLogP0.99
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-[2-(methylamino)propyl]-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;dihydrochloride
CID 120830779
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 111565960
3-methyl-N-(2-piperazin-1-ylethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;dihydrochloride
CID 119449154
N-(1-aminohexan-2-yl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 119668708
5-bromo-N-[(2R)-2-(ethylamino)propyl]pyridine-3-carboxamide;dihydrochloride
CID 120653060
N-[1-(aminomethyl)cyclopentyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 119568411
N-[(2R)-2-(ethylamino)propyl]-2-(5-methyl-1H-pyrazol-3-yl)acetamide;hydrochloride
CID 120652004
3-methyl-N-piperidin-3-yl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 119429140
N-[(2R)-2-(ethylamino)propyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 120654191
3-methyl-N-piperidin-3-yl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;dihydrochloride
CID 119429139
N-[(2R)-2-(ethylamino)propyl]-3,5-difluorobenzamide
CID 120653813
N-ethyl-3-methyl-2H-indazole-5-carboxamide
CID 58243589

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide (CID 120654061) is N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide is CCN[C@H](C)CNC(=O)c1cnc2n[nH]c(C)c2c1.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is PETXCHGNAJOTAN-MRVPVSSYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-4-14-8(2)6-16-13(19)10-5-11-9(3)17-18-12(11)15-7-10/h5,7-8,14H,4,6H2,1-3H3,(H,16,19)(H,15,17,18)/t8-/m1/s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 261.33 g/mol, XLogP of 0.99, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 120654061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).