5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine

C11H19N3S — CID 62752236

IUPAC5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)N(CC1CC1)c1ncc(CN)s1
InChIInChI=1S/C11H19N3S/c1-8(2)14(7-9-3-4-9)11-13-6-10(5-12)15-11/h6,8-9H,3-5,7,12H2,1-2H3
InChIKeyLHMCQOHMNFHVLB-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.23
Rot. Bonds5

About 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine

5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 62752236) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine
PubChem CID62752236
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)N(CC1CC1)c1ncc(CN)s1
InChIInChI=1S/C11H19N3S/c1-8(2)14(7-9-3-4-9)11-13-6-10(5-12)15-11/h6,8-9H,3-5,7,12H2,1-2H3
InChIKeyLHMCQOHMNFHVLB-UHFFFAOYSA-N
XLogP2.23
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 ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine (CID 62752236) is 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine is CC(C)N(CC1CC1)c1ncc(CN)s1.
What is the InChIKey of 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is LHMCQOHMNFHVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-8(2)14(7-9-3-4-9)11-13-6-10(5-12)15-11/h6,8-9H,3-5,7,12H2,1-2H3.
What are the key properties of 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 225.36 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(cyclopropylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 62752236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).