N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine

C15H23N5S — CID 103332655

IUPACN-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCCN(c1nc(NN)nc2sc(CC)cc12)C1CC1
InChIInChI=1S/C15H23N5S/c1-3-5-8-20(10-6-7-10)13-12-9-11(4-2)21-14(12)18-15(17-13)19-16/h9-10H,3-8,16H2,1-2H3,(H,17,18,19)
InChIKeyDPVVHACJKQDBQO-UHFFFAOYSA-N
MW305.45 g/mol
LogP3.31
Rot. Bonds7

About N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine

N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 103332655) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
PubChem CID103332655
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC NameN-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCCN(c1nc(NN)nc2sc(CC)cc12)C1CC1
InChIInChI=1S/C15H23N5S/c1-3-5-8-20(10-6-7-10)13-12-9-11(4-2)21-14(12)18-15(17-13)19-16/h9-10H,3-8,16H2,1-2H3,(H,17,18,19)
InChIKeyDPVVHACJKQDBQO-UHFFFAOYSA-N
XLogP3.31
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 53.31
H-Bond Donors ≤ 52
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

N-cyclopropyl-6-ethyl-2-hydrazinyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 103332146
4-N-cyclopropyl-2-N,6-diethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324607
N-butyl-6-ethyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103334096
6-ethyl-2-hydrazinyl-N,N-dipropylthieno[2,3-d]pyrimidin-4-amine
CID 103335029
N-cyclohexyl-6-ethyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103334924
[4-(3,4-dimethylpyrrolidin-1-yl)-6-ethylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103334491
4-N-cyclopropyl-6-ethyl-2-N,4-N-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324556
N-cyclopentyl-N-ethyl-2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 103332300
2-chloro-N-cyclopropyl-6-ethyl-N-(2-methoxyethyl)thieno[2,3-d]pyrimidin-4-amine
CID 103320932
N-(2,2-difluoroethyl)-6-ethyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103335769
6-ethyl-2-hydrazinyl-N-methyl-N-(4-methylpentan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103333041
N-cyclopropyl-2-hydrazinyl-6-methyl-N-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine
CID 103333103

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine (CID 103332655) is N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine is CCCCN(c1nc(NN)nc2sc(CC)cc12)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is DPVVHACJKQDBQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-3-5-8-20(10-6-7-10)13-12-9-11(4-2)21-14(12)18-15(17-13)19-16/h9-10H,3-8,16H2,1-2H3,(H,17,18,19).
What are the key properties of N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 305.45 g/mol, XLogP of 3.31, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103332655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).