N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine

C16H24N2S — CID 64513827

IUPACN-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine
SMILESCC1CCC(NC2CC2)(c2nc3c(s2)CCCC3)C1
InChIInChI=1S/C16H24N2S/c1-11-8-9-16(10-11,18-12-6-7-12)15-17-13-4-2-3-5-14(13)19-15/h11-12,18H,2-10H2,1H3
InChIKeyJSIXNDFUYDADEB-UHFFFAOYSA-N
MW276.45 g/mol
LogP3.79
Rot. Bonds3

About N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine

N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine (PubChem CID 64513827) has the molecular formula C16H24N2S and a molecular weight of 276.45 g/mol. Its IUPAC name is N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine
PubChem CID64513827
Molecular FormulaC16H24N2S
Molecular Weight276.45 g/mol
Exact Mass276.17
IUPAC NameN-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine
SMILESCC1CCC(NC2CC2)(c2nc3c(s2)CCCC3)C1
InChIInChI=1S/C16H24N2S/c1-11-8-9-16(10-11,18-12-6-7-12)15-17-13-4-2-3-5-14(13)19-15/h11-12,18H,2-10H2,1H3
InChIKeyJSIXNDFUYDADEB-UHFFFAOYSA-N
XLogP3.79
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-cyclopropyl-1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-methylcyclopentan-1-amine
CID 64513598
N-cyclopropyl-4-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclohexan-1-amine
CID 61335863
N-cyclopropyl-3-propan-2-yl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclobutan-1-amine
CID 103563952
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-3-methylcyclopentan-1-amine
CID 64513823
N-cyclopropyl-2,5-dimethyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclohexan-1-amine
CID 64756212
N-cyclopropyl-1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-propylcyclohexan-1-amine
CID 63405358
N-cyclopropyl-1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2,5-dimethylcyclohexan-1-amine
CID 64756005
N-ethyl-4-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cycloheptan-1-amine
CID 65084641
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methoxy-N-methylcyclohexan-1-amine
CID 113414536
N,2,5-trimethyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclohexan-1-amine
CID 64756206
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,3,3,5-tetramethylcyclohexan-1-amine
CID 61332157
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2,5-dimethylcyclohexan-1-amine
CID 64754364

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine?
The IUPAC name of N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine (CID 64513827) is N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine is CC1CCC(NC2CC2)(c2nc3c(s2)CCCC3)C1.
What is the InChIKey of N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine?
The InChIKey is JSIXNDFUYDADEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2S/c1-11-8-9-16(10-11,18-12-6-7-12)15-17-13-4-2-3-5-14(13)19-15/h11-12,18H,2-10H2,1H3.
What are the key properties of N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine?
N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine has a molecular weight of 276.45 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 64513827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).