5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide

C14H22N2OS — CID 103802126

IUPAC5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide
SMILESCCC1(CNCc2cc(C(N)=O)cs2)CCCC1
InChIInChI=1S/C14H22N2OS/c1-2-14(5-3-4-6-14)10-16-8-12-7-11(9-18-12)13(15)17/h7,9,16H,2-6,8,10H2,1H3,(H2,15,17)
InChIKeyFYPGBHDDLAJOSM-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.91
Rot. Bonds6

About 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide

5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide (PubChem CID 103802126) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide
PubChem CID103802126
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide
SMILESCCC1(CNCc2cc(C(N)=O)cs2)CCCC1
InChIInChI=1S/C14H22N2OS/c1-2-14(5-3-4-6-14)10-16-8-12-7-11(9-18-12)13(15)17/h7,9,16H,2-6,8,10H2,1H3,(H2,15,17)
InChIKeyFYPGBHDDLAJOSM-UHFFFAOYSA-N
XLogP2.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[[[1-(hydroxymethyl)cyclohexyl]methylamino]methyl]thiophene-3-carboxamide
CID 112701033
5-[[(1-cyclopropylcyclopropyl)methylamino]methyl]thiophene-3-carboxamide
CID 113321738
5-(butylaminomethyl)thiophene-3-carboxamide
CID 79606629
4-[[(1-ethylcyclobutyl)methylamino]methyl]benzamide
CID 103741169
5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide
CID 115735684
5-[[[1-(2-hydroxyethyl)cyclopropyl]methylamino]methyl]thiophene-3-carboxylic acid
CID 114756041
1-(4-bromothiophen-2-yl)-N-[(1-ethylcyclopropyl)methyl]methanamine;hydrochloride
CID 115680308
5-[[(4-methyloxan-4-yl)amino]methyl]thiophene-3-carboxamide
CID 115758077
5-[[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]methyl]thiophene-3-carboxamide
CID 104923448
5-[(3,3-dimethylbutylamino)methyl]thiophene-3-carboxamide
CID 115735473
5-[(2,3-dimethylbutylamino)methyl]thiophene-3-carboxamide
CID 79613545
5-[(2,2-diethoxyethylamino)methyl]thiophene-3-carboxamide
CID 79614481

Frequently Asked Questions

What is the IUPAC name of 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide?
The IUPAC name of 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide (CID 103802126) is 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide.
What is the SMILES notation for 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide?
The canonical SMILES for 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide is CCC1(CNCc2cc(C(N)=O)cs2)CCCC1.
What is the InChIKey of 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide?
The InChIKey is FYPGBHDDLAJOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-2-14(5-3-4-6-14)10-16-8-12-7-11(9-18-12)13(15)17/h7,9,16H,2-6,8,10H2,1H3,(H2,15,17).
What are the key properties of 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide?
5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide has a molecular weight of 266.41 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide is sourced from PubChem (CID 103802126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).