N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide

C14H17N3O2S — CID 119602827

IUPACN-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide
SMILESNCC1CCCC1NC(=O)c1cnc(-c2ccco2)s1
InChIInChI=1S/C14H17N3O2S/c15-7-9-3-1-4-10(9)17-13(18)12-8-16-14(20-12)11-5-2-6-19-11/h2,5-6,8-10H,1,3-4,7,15H2,(H,17,18)
InChIKeyUXRQKUJJXDLPBC-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.26
Rot. Bonds4

About N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide

N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide (PubChem CID 119602827) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide
PubChem CID119602827
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide
SMILESNCC1CCCC1NC(=O)c1cnc(-c2ccco2)s1
InChIInChI=1S/C14H17N3O2S/c15-7-9-3-1-4-10(9)17-13(18)12-8-16-14(20-12)11-5-2-6-19-11/h2,5-6,8-10H,1,3-4,7,15H2,(H,17,18)
InChIKeyUXRQKUJJXDLPBC-UHFFFAOYSA-N
XLogP2.26
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(furan-2-yl)-N-(2-methylpiperidin-3-yl)-1,3-thiazole-5-carboxamide
CID 120577393
N-[2-(aminomethyl)cyclohexyl]-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119610162
N-[2-(aminomethyl)cyclopentyl]-2-(1,3-benzodioxol-5-yl)-1,3-thiazole-5-carboxamide
CID 119602212
N-[(2-tert-butyloxan-3-yl)methyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide
CID 86971621
N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride
CID 119603692
2-[[2-(furan-2-yl)-1,3-thiazole-5-carbonyl]amino]-2-methylpropanoic acid
CID 119187621
N-(1-benzylsulfonylpiperidin-4-yl)-2-(furan-2-yl)-1,3-thiazole-5-carboxamide
CID 86967943
2-(furan-2-yl)-N-(2-piperazin-1-ylethyl)-1,3-thiazole-5-carboxamide
CID 119446974
N-[(1S,2R)-2-(aminomethyl)cyclopentyl]benzamide
CID 94903786
[2-(furan-2-yl)-1,3-thiazol-5-yl]-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 119650303
N-[3-[[2-(aminomethyl)cyclopentyl]amino]-3-oxopropyl]furan-2-carboxamide
CID 119601214
N-(2-aminoethyl)-1-[2-(furan-2-yl)-1,3-thiazole-5-carbonyl]piperidine-3-carboxamide;dihydrochloride
CID 119480750

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide (CID 119602827) is N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide is NCC1CCCC1NC(=O)c1cnc(-c2ccco2)s1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is UXRQKUJJXDLPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c15-7-9-3-1-4-10(9)17-13(18)12-8-16-14(20-12)11-5-2-6-19-11/h2,5-6,8-10H,1,3-4,7,15H2,(H,17,18).
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide?
N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 119602827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).