2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine

C9H15N3S — CID 102767554

IUPAC2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine
SMILESCCCN(c1ncc(N)s1)C1CC1
InChIInChI=1S/C9H15N3S/c1-2-5-12(7-3-4-7)9-11-6-8(10)13-9/h6-7H,2-5,10H2,1H3
InChIKeyAVEYJXZGABEGJH-UHFFFAOYSA-N
MW197.31 g/mol
LogP2.10
Rot. Bonds4

About 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine

2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine (PubChem CID 102767554) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine
PubChem CID102767554
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC Name2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine
SMILESCCCN(c1ncc(N)s1)C1CC1
InChIInChI=1S/C9H15N3S/c1-2-5-12(7-3-4-7)9-11-6-8(10)13-9/h6-7H,2-5,10H2,1H3
InChIKeyAVEYJXZGABEGJH-UHFFFAOYSA-N
XLogP2.10
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine?
The IUPAC name of 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine (CID 102767554) is 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine.
What is the SMILES notation for 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine?
The canonical SMILES for 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine is CCCN(c1ncc(N)s1)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine?
The InChIKey is AVEYJXZGABEGJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-2-5-12(7-3-4-7)9-11-6-8(10)13-9/h6-7H,2-5,10H2,1H3.
What are the key properties of 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine?
2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine has a molecular weight of 197.31 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-2-N-propyl-1,3-thiazole-2,5-diamine is sourced from PubChem (CID 102767554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).