5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine

C11H19N3S — CID 62766909

IUPAC5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine
SMILESCCCc1nc(N(C)C2CC2)sc1CN
InChIInChI=1S/C11H19N3S/c1-3-4-9-10(7-12)15-11(13-9)14(2)8-5-6-8/h8H,3-7,12H2,1-2H3
InChIKeyUKNDSIODBRAEPX-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.15
Rot. Bonds5

About 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine

5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine (PubChem CID 62766909) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine
PubChem CID62766909
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine
SMILESCCCc1nc(N(C)C2CC2)sc1CN
InChIInChI=1S/C11H19N3S/c1-3-4-9-10(7-12)15-11(13-9)14(2)8-5-6-8/h8H,3-7,12H2,1-2H3
InChIKeyUKNDSIODBRAEPX-UHFFFAOYSA-N
XLogP2.15
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine (CID 62766909) is 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine is CCCc1nc(N(C)C2CC2)sc1CN.
What is the InChIKey of 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine?
The InChIKey is UKNDSIODBRAEPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-3-4-9-10(7-12)15-11(13-9)14(2)8-5-6-8/h8H,3-7,12H2,1-2H3.
What are the key properties of 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine?
5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine has a molecular weight of 225.36 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-cyclopropyl-N-methyl-4-propyl-1,3-thiazol-2-amine is sourced from PubChem (CID 62766909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).