N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine

C14H22N2S — CID 62071955

IUPACN-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine
SMILESCCNC(c1nc2c(s1)CCC2)C1CCCC1
InChIInChI=1S/C14H22N2S/c1-2-15-13(10-6-3-4-7-10)14-16-11-8-5-9-12(11)17-14/h10,13,15H,2-9H2,1H3
InChIKeyCMIZBWFYEIJZHT-UHFFFAOYSA-N
MW250.41 g/mol
LogP3.47
Rot. Bonds4

About N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine

N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine (PubChem CID 62071955) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine
PubChem CID62071955
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC NameN-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine
SMILESCCNC(c1nc2c(s1)CCC2)C1CCCC1
InChIInChI=1S/C14H22N2S/c1-2-15-13(10-6-3-4-7-10)14-16-11-8-5-9-12(11)17-14/h10,13,15H,2-9H2,1H3
InChIKeyCMIZBWFYEIJZHT-UHFFFAOYSA-N
XLogP3.47
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]-2-methoxyethanamine
CID 62542086
N-[cyclopentyl(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methyl]-2-methoxyethanamine
CID 62541901
N-[cyclohexyl-(4,5-dimethyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 61330809
N-[1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)propyl]cyclopropanamine
CID 61333321
N-[cyclohexyl(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)methyl]ethanamine
CID 114981660
N-[(4-cyclopropylphenyl)-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine
CID 79972579
N-[cyclopentyl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]ethanamine
CID 115778778
N-[oxan-4-yl(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methyl]propan-2-amine
CID 62385438
N-[5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl-(1-methylsulfanylcyclobutyl)methyl]ethanamine
CID 114269916
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-3-ethylsulfanylpropan-1-amine
CID 116504467
N-[5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl-(5-methylthiophen-2-yl)methyl]ethanamine
CID 61347365
N-[5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl-(2,4,6-trimethylphenyl)methyl]ethanamine
CID 61332193

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine?
The IUPAC name of N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine (CID 62071955) is N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine?
The canonical SMILES for N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine is CCNC(c1nc2c(s1)CCC2)C1CCCC1.
What is the InChIKey of N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine?
The InChIKey is CMIZBWFYEIJZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2S/c1-2-15-13(10-6-3-4-7-10)14-16-11-8-5-9-12(11)17-14/h10,13,15H,2-9H2,1H3.
What are the key properties of N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine?
N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine has a molecular weight of 250.41 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)methyl]ethanamine is sourced from PubChem (CID 62071955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).