7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine

C14H17N5S — CID 162785048

IUPAC7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
SMILESCC(C)CNc1cc(N)nc2cc(-c3ccn[nH]3)sc12
InChIInChI=1S/C14H17N5S/c1-8(2)7-16-10-6-13(15)18-11-5-12(20-14(10)11)9-3-4-17-19-9/h3-6,8H,7H2,1-2H3,(H,17,19)(H3,15,16,18)
InChIKeyCAVREJDVOIQZSR-UHFFFAOYSA-N
MW287.39 g/mol
LogP3.34
Rot. Bonds4

About 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine

7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine (PubChem CID 162785048) has the molecular formula C14H17N5S and a molecular weight of 287.39 g/mol. Its IUPAC name is 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine.

Molecular Properties

Compound Name7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
PubChem CID162785048
Molecular FormulaC14H17N5S
Molecular Weight287.39 g/mol
Exact Mass287.12
IUPAC Name7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
SMILESCC(C)CNc1cc(N)nc2cc(-c3ccn[nH]3)sc12
InChIInChI=1S/C14H17N5S/c1-8(2)7-16-10-6-13(15)18-11-5-12(20-14(10)11)9-3-4-17-19-9/h3-6,8H,7H2,1-2H3,(H,17,19)(H3,15,16,18)
InChIKeyCAVREJDVOIQZSR-UHFFFAOYSA-N
XLogP3.34
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 53.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

7-N-[2-[[amino(methyl)amino]methyl]but-3-enyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
CID 166905401
7-N-(1-methoxypropan-2-yl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
CID 162785025
7-N-(cyclopropylmethyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine;hydrochloride
CID 162785059
7-N-[(3-methyloxetan-3-yl)methyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
CID 162784965
2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol
CID 166905459
1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol
CID 154684721
2-(2,3-dihydro-1H-pyrazol-5-yl)-7-N-[(2R)-2-methoxypropyl]thieno[3,2-b]pyridine-5,7-diamine
CID 166905442
7-(4,4-dimethylpiperidin-1-yl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine
CID 162784892
(2R)-3-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propane-1,2-diol
CID 137417579
N-(2-methylpropyl)-4-[[5-(1H-pyrazol-5-yl)-1,3-thiazol-2-yl]oxy]aniline
CID 141350267
7-(3-methoxypyrrolidin-1-yl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine
CID 162784956
7-[(2R)-2-methylmorpholin-4-yl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine
CID 162785043

Frequently Asked Questions

What is the IUPAC name of 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?
The IUPAC name of 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine (CID 162785048) is 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine.
What is the SMILES notation for 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?
The canonical SMILES for 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine is CC(C)CNc1cc(N)nc2cc(-c3ccn[nH]3)sc12.
What is the InChIKey of 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?
The InChIKey is CAVREJDVOIQZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5S/c1-8(2)7-16-10-6-13(15)18-11-5-12(20-14(10)11)9-3-4-17-19-9/h3-6,8H,7H2,1-2H3,(H,17,19)(H3,15,16,18).
What are the key properties of 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?
7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine has a molecular weight of 287.39 g/mol, XLogP of 3.34, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine is sourced from PubChem (CID 162785048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).