N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide

C14H22N2OS — CID 8890905

IUPACN-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide
SMILESCc1ccsc1CN(C)CC(=O)NC1CCCC1
InChIInChI=1S/C14H22N2OS/c1-11-7-8-18-13(11)9-16(2)10-14(17)15-12-5-3-4-6-12/h7-8,12H,3-6,9-10H2,1-2H3,(H,15,17)
InChIKeyWEWKHTUNKOWEAS-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.55
Rot. Bonds5

About N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide

N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide (PubChem CID 8890905) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide
PubChem CID8890905
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide
SMILESCc1ccsc1CN(C)CC(=O)NC1CCCC1
InChIInChI=1S/C14H22N2OS/c1-11-7-8-18-13(11)9-16(2)10-14(17)15-12-5-3-4-6-12/h7-8,12H,3-6,9-10H2,1-2H3,(H,15,17)
InChIKeyWEWKHTUNKOWEAS-UHFFFAOYSA-N
XLogP2.55
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 ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide (CID 8890905) is N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide is Cc1ccsc1CN(C)CC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?
The InChIKey is WEWKHTUNKOWEAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-11-7-8-18-13(11)9-16(2)10-14(17)15-12-5-3-4-6-12/h7-8,12H,3-6,9-10H2,1-2H3,(H,15,17).
What are the key properties of N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?
N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide has a molecular weight of 266.41 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide is sourced from PubChem (CID 8890905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).