N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine

C12H17N5S — CID 103333826

IUPACN-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
SMILESCC(CC1CC1)Nc1nc(NN)nc2sccc12
InChIInChI=1S/C12H17N5S/c1-7(6-8-2-3-8)14-10-9-4-5-18-11(9)16-12(15-10)17-13/h4-5,7-8H,2-3,6,13H2,1H3,(H2,14,15,16,17)
InChIKeyRSNPIXFMZCLXSQ-UHFFFAOYSA-N
MW263.37 g/mol
LogP2.58
Rot. Bonds5

About N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine

N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 103333826) has the molecular formula C12H17N5S and a molecular weight of 263.37 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
PubChem CID103333826
Molecular FormulaC12H17N5S
Molecular Weight263.37 g/mol
Exact Mass263.12
IUPAC NameN-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
SMILESCC(CC1CC1)Nc1nc(NN)nc2sccc12
InChIInChI=1S/C12H17N5S/c1-7(6-8-2-3-8)14-10-9-4-5-18-11(9)16-12(15-10)17-13/h4-5,7-8H,2-3,6,13H2,1H3,(H2,14,15,16,17)
InChIKeyRSNPIXFMZCLXSQ-UHFFFAOYSA-N
XLogP2.58
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydrazinyl-N-(5-methylhexan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103333804
2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103333992
2-hydrazinyl-N-(1-morpholin-4-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103332803
N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103333215
4-N-(1-cyclopropylbutan-2-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328065
N-[3-(cyclopropylmethoxy)propyl]-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 114098440
2-N-methyl-4-N-(4-methylpentan-2-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324758
5-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]pentan-2-ol
CID 106138733
N-(4-ethylcyclohexyl)-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103332677
4-N-[1-(dimethylamino)propan-2-yl]-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329471
2-hydrazinyl-N-(2-methyloxolan-3-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103335505
2-hydrazinyl-N-(2-phenylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 103335640

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine (CID 103333826) is N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine is CC(CC1CC1)Nc1nc(NN)nc2sccc12.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is RSNPIXFMZCLXSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5S/c1-7(6-8-2-3-8)14-10-9-4-5-18-11(9)16-12(15-10)17-13/h4-5,7-8H,2-3,6,13H2,1H3,(H2,14,15,16,17).
What are the key properties of N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 263.37 g/mol, XLogP of 2.58, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103333826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).