N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine

C9H12F2N2S — CID 131091806

IUPACN-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine
SMILESFC1(F)CCCC1CNc1nccs1
InChIInChI=1S/C9H12F2N2S/c10-9(11)3-1-2-7(9)6-13-8-12-4-5-14-8/h4-5,7H,1-3,6H2,(H,12,13)
InChIKeyRIEWAOMHGJUNQW-UHFFFAOYSA-N
MW218.27 g/mol
LogP2.99
Rot. Bonds3

About N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine

N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine (PubChem CID 131091806) has the molecular formula C9H12F2N2S and a molecular weight of 218.27 g/mol. Its IUPAC name is N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine
PubChem CID131091806
Molecular FormulaC9H12F2N2S
Molecular Weight218.27 g/mol
Exact Mass218.07
IUPAC NameN-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine
SMILESFC1(F)CCCC1CNc1nccs1
InChIInChI=1S/C9H12F2N2S/c10-9(11)3-1-2-7(9)6-13-8-12-4-5-14-8/h4-5,7H,1-3,6H2,(H,12,13)
InChIKeyRIEWAOMHGJUNQW-UHFFFAOYSA-N
XLogP2.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.27
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-chlorocyclopentyl)methyl]-1,3-thiazol-2-amine
CID 106123958
3-[(1,3-thiazol-2-ylamino)methyl]cyclobutan-1-ol
CID 66006565
N-(cyclohex-3-en-1-ylmethyl)-1,3-thiazol-2-amine
CID 78976841
N-[[(3S)-pyrrolidin-3-yl]methyl]-1,3-thiazol-2-amine
CID 96996514
N-[(1-methylcyclopropyl)methyl]-1,3-thiazol-2-amine
CID 107143585
N-cyclopropyl-N'-(1,3-thiazol-2-yl)ethane-1,2-diamine
CID 62663409
N-(2-cyclopentyloxyethyl)-1,3-thiazol-2-amine
CID 60965150
CID 59694819
CID 59694819
N-[[1-(aminomethyl)cyclohexyl]methyl]-1,3-thiazol-2-amine
CID 103970472
N-(2-cyclohexyloxyethyl)-1,3-thiazol-2-amine
CID 61063883
N-[[1-(aminomethyl)cyclopropyl]methyl]-1,3-thiazol-2-amine
CID 115457087
4-cyclohexyl-4-[(1,3-thiazol-2-ylamino)methyl]piperidine-1-carboxylic acid
CID 22185327

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine (CID 131091806) is N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine is FC1(F)CCCC1CNc1nccs1.
What is the InChIKey of N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine?
The InChIKey is RIEWAOMHGJUNQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2S/c10-9(11)3-1-2-7(9)6-13-8-12-4-5-14-8/h4-5,7H,1-3,6H2,(H,12,13).
What are the key properties of N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine?
N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine has a molecular weight of 218.27 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-difluorocyclopentyl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 131091806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).