4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine

C14H23N3S — CID 65077594

IUPAC4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine
SMILESCCN1CCCC(N)(c2nc3c(s2)CCC3)CC1
InChIInChI=1S/C14H23N3S/c1-2-17-9-4-7-14(15,8-10-17)13-16-11-5-3-6-12(11)18-13/h2-10,15H2,1H3
InChIKeySXTRCNNLKAZABK-UHFFFAOYSA-N
MW265.43 g/mol
LogP2.29
Rot. Bonds2

About 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine

4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine (PubChem CID 65077594) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine.

Molecular Properties

Compound Name4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine
PubChem CID65077594
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine
SMILESCCN1CCCC(N)(c2nc3c(s2)CCC3)CC1
InChIInChI=1S/C14H23N3S/c1-2-17-9-4-7-14(15,8-10-17)13-16-11-5-3-6-12(11)18-13/h2-10,15H2,1H3
InChIKeySXTRCNNLKAZABK-UHFFFAOYSA-N
XLogP2.29
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclohexan-1-amine
CID 61338476
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylcycloheptan-1-amine
CID 65085220
1-ethyl-4-(4-methyl-1,3-thiazol-2-yl)azepan-4-amine
CID 65077391
3,3-dimethyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cyclopentan-1-amine
CID 80699805
3-cyclopropyl-1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)cyclohexan-1-amine
CID 64624248
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine
CID 103563881
1-ethyl-4-(4-methyl-1,3-thiazol-2-yl)piperidin-4-amine
CID 61332240
1-(6-propyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)cycloheptan-1-amine
CID 63526246
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethylcyclooctan-1-amine
CID 61332209
3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-azabicyclo[2.2.2]octan-3-amine
CID 61331499
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-propylcyclobutan-1-amine
CID 61333808
1-methyl-N-propyl-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)azepan-4-amine
CID 65075437

Frequently Asked Questions

What is the IUPAC name of 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine?
The IUPAC name of 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine (CID 65077594) is 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine.
What is the SMILES notation for 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine?
The canonical SMILES for 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine is CCN1CCCC(N)(c2nc3c(s2)CCC3)CC1.
What is the InChIKey of 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine?
The InChIKey is SXTRCNNLKAZABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3S/c1-2-17-9-4-7-14(15,8-10-17)13-16-11-5-3-6-12(11)18-13/h2-10,15H2,1H3.
What are the key properties of 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine?
4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine has a molecular weight of 265.43 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-ethylazepan-4-amine is sourced from PubChem (CID 65077594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).