N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine

C13H20N2S — CID 64516678

IUPACN-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCCC1CCC(NC2CC2)(c2nccs2)C1
InChIInChI=1S/C13H20N2S/c1-2-10-5-6-13(9-10,15-11-3-4-11)12-14-7-8-16-12/h7-8,10-11,15H,2-6,9H2,1H3
InChIKeyVDTPVXDEJDHOLN-UHFFFAOYSA-N
MW236.38 g/mol
LogP3.30
Rot. Bonds4

About N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine

N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine (PubChem CID 64516678) has the molecular formula C13H20N2S and a molecular weight of 236.38 g/mol. Its IUPAC name is N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
PubChem CID64516678
Molecular FormulaC13H20N2S
Molecular Weight236.38 g/mol
Exact Mass236.13
IUPAC NameN-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCCC1CCC(NC2CC2)(c2nccs2)C1
InChIInChI=1S/C13H20N2S/c1-2-10-5-6-13(9-10,15-11-3-4-11)12-14-7-8-16-12/h7-8,10-11,15H,2-6,9H2,1H3
InChIKeyVDTPVXDEJDHOLN-UHFFFAOYSA-N
XLogP3.30
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-N-(2-methoxyethyl)-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
CID 64514523
N-cyclopropyl-3-methyl-1-(1,3-thiazol-2-yl)cyclobutan-1-amine
CID 103563943
N-cyclopropyl-1-(1,3-thiazol-2-yl)cyclohexan-1-amine
CID 61334064
4-ethyl-N-(2-methoxyethyl)-1-(1,3-thiazol-2-yl)cyclohexan-1-amine
CID 62542779
4-ethyl-N-propyl-1-(1,3-thiazol-2-yl)cycloheptan-1-amine
CID 65086079
N-cyclopropyl-1-ethyl-4-(1,3-thiazol-2-yl)azepan-4-amine
CID 65077299
N-ethyl-1-(1,3-thiazol-2-yl)cyclododecan-1-amine
CID 63405296
N-cyclopropyl-2-methyl-3-(1,3-thiazol-2-yl)thian-3-amine
CID 79951354
N-(2-methoxyethyl)-4-propyl-1-(1,3-thiazol-2-yl)cycloheptan-1-amine
CID 65090297
4-(2-methylbutan-2-yl)-N-propyl-1-(1,3-thiazol-2-yl)cyclohexan-1-amine
CID 63405391
N-propyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
CID 61332772
N-ethyl-3-propan-2-yl-1-(1,3-thiazol-2-yl)cyclobutan-1-amine
CID 103563902

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The IUPAC name of N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine (CID 64516678) is N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine is CCC1CCC(NC2CC2)(c2nccs2)C1.
What is the InChIKey of N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The InChIKey is VDTPVXDEJDHOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2S/c1-2-10-5-6-13(9-10,15-11-3-4-11)12-14-7-8-16-12/h7-8,10-11,15H,2-6,9H2,1H3.
What are the key properties of N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine has a molecular weight of 236.38 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 64516678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).