N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide

C14H22N2OS — CID 86848703

IUPACN-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide
SMILESCN(CCNC(=O)c1cccs1)C1CCCCC1
InChIInChI=1S/C14H22N2OS/c1-16(12-6-3-2-4-7-12)10-9-15-14(17)13-8-5-11-18-13/h5,8,11-12H,2-4,6-7,9-10H2,1H3,(H,15,17)
InChIKeyVYCJUNRDROJIJV-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.74
Rot. Bonds5

About N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide

N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide (PubChem CID 86848703) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide
PubChem CID86848703
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide
SMILESCN(CCNC(=O)c1cccs1)C1CCCCC1
InChIInChI=1S/C14H22N2OS/c1-16(12-6-3-2-4-7-12)10-9-15-14(17)13-8-5-11-18-13/h5,8,11-12H,2-4,6-7,9-10H2,1H3,(H,15,17)
InChIKeyVYCJUNRDROJIJV-UHFFFAOYSA-N
XLogP2.74
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[acetyl(cyclopentyl)amino]ethyl]thiophene-2-carboxamide
CID 113052781
N-[4-[cyclopentyl(ethyl)amino]-4-oxobutyl]thiophene-2-carboxamide
CID 134060864
[2-[cyclohexyl(ethyl)amino]-2-oxoethyl] 3-(thiophene-2-carbonylamino)propanoate
CID 46812642
N-[2-[cyclohexyl(methyl)amino]ethyl]-3-methylbenzamide
CID 121420012
2-bromo-N-[2-[cyclopentyl(methyl)amino]ethyl]benzamide
CID 63316134
N-(2-aminoethyl)thiophene-2-carboxamide
CID 4649097
methyl 2-[cyclopentyl(thiophene-2-carbonyl)amino]acetate
CID 80709531
N-[2-(cyclooctylamino)-2-oxoethyl]thiophene-2-carboxamide
CID 4082368
N-[2-[cyclohexyl(methyl)amino]ethyl]-5-cyclopropylthieno[2,3-c]pyrrole-2-carboxamide
CID 53191585
N-[2-(oxan-2-yl)ethyl]thiophene-2-carboxamide
CID 103993193
N'-cyclopentyl-N'-methyl-N-(1-thiophen-2-ylethyl)ethane-1,2-diamine
CID 62574004
N-[2-(N-acetylanilino)ethyl]thiophene-2-carboxamide
CID 113057163

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide (CID 86848703) is N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide is CN(CCNC(=O)c1cccs1)C1CCCCC1.
What is the InChIKey of N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide?
The InChIKey is VYCJUNRDROJIJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-16(12-6-3-2-4-7-12)10-9-15-14(17)13-8-5-11-18-13/h5,8,11-12H,2-4,6-7,9-10H2,1H3,(H,15,17).
What are the key properties of N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide?
N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide has a molecular weight of 266.41 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 86848703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).