N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide

C14H22N2OS — CID 3226809

IUPACN-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide
SMILESCC(NCc1cccs1)C(=O)NC1CCCCC1
InChIInChI=1S/C14H22N2OS/c1-11(15-10-13-8-5-9-18-13)14(17)16-12-6-3-2-4-7-12/h5,8-9,11-12,15H,2-4,6-7,10H2,1H3,(H,16,17)
InChIKeyNGIIGAXVSRSFKU-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.68
Rot. Bonds5

About N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide

N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide (PubChem CID 3226809) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide
PubChem CID3226809
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide
SMILESCC(NCc1cccs1)C(=O)NC1CCCCC1
InChIInChI=1S/C14H22N2OS/c1-11(15-10-13-8-5-9-18-13)14(17)16-12-6-3-2-4-7-12/h5,8-9,11-12,15H,2-4,6-7,10H2,1H3,(H,16,17)
InChIKeyNGIIGAXVSRSFKU-UHFFFAOYSA-N
XLogP2.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide?
The IUPAC name of N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide (CID 3226809) is N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide.
What is the SMILES notation for N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide?
The canonical SMILES for N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide is CC(NCc1cccs1)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide?
The InChIKey is NGIIGAXVSRSFKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-11(15-10-13-8-5-9-18-13)14(17)16-12-6-3-2-4-7-12/h5,8-9,11-12,15H,2-4,6-7,10H2,1H3,(H,16,17).
What are the key properties of N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide?
N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide has a molecular weight of 266.41 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(thiophen-2-ylmethylamino)propanamide is sourced from PubChem (CID 3226809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).