N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide

C15H24N2OS — CID 65244170

IUPACN-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide
SMILESCc1cc(CNC(C)C(=O)NC2CCCC2)sc1C
InChIInChI=1S/C15H24N2OS/c1-10-8-14(19-12(10)3)9-16-11(2)15(18)17-13-6-4-5-7-13/h8,11,13,16H,4-7,9H2,1-3H3,(H,17,18)
InChIKeyBKBNDTLYCGBBIV-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.90
Rot. Bonds5

About N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide

N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide (PubChem CID 65244170) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide
PubChem CID65244170
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC NameN-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide
SMILESCc1cc(CNC(C)C(=O)NC2CCCC2)sc1C
InChIInChI=1S/C15H24N2OS/c1-10-8-14(19-12(10)3)9-16-11(2)15(18)17-13-6-4-5-7-13/h8,11,13,16H,4-7,9H2,1-3H3,(H,17,18)
InChIKeyBKBNDTLYCGBBIV-UHFFFAOYSA-N
XLogP2.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-methylpropanamide
CID 65244115
N-cyclopentyl-2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)propanamide
CID 61207988
methyl 2-[(4,5-dimethylthiophen-2-yl)methylamino]propanoate
CID 65243717
N-cyclopentyl-2-[(2-methylphenyl)methylamino]propanamide
CID 60647813
N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide
CID 60647843
N-cyclopentyl-2-[(4-methylphenyl)methylamino]propanamide
CID 43083735
N-cyclopentyl-2-[(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)methylamino]propanamide
CID 50956481
N-[(4,5-dimethylthiophen-2-yl)methyl]-1-(1-ethylpiperidin-3-yl)ethanamine
CID 65246481
N-cyclopropyl-2-[(2,6-dimethylphenyl)methylamino]propanamide
CID 112700004
2-bromo-N-[(4,5-dimethylthiophen-2-yl)methyl]propanamide
CID 107905367
N-cyclopentyl-2-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)methylamino]propanamide
CID 50948384
2-[(3-bromophenyl)methylamino]-N-cyclohexylpropanamide
CID 61401079

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide?
The IUPAC name of N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide (CID 65244170) is N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide.
What is the SMILES notation for N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide?
The canonical SMILES for N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide is Cc1cc(CNC(C)C(=O)NC2CCCC2)sc1C.
What is the InChIKey of N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide?
The InChIKey is BKBNDTLYCGBBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-10-8-14(19-12(10)3)9-16-11(2)15(18)17-13-6-4-5-7-13/h8,11,13,16H,4-7,9H2,1-3H3,(H,17,18).
What are the key properties of N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide?
N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide has a molecular weight of 280.44 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(4,5-dimethylthiophen-2-yl)methylamino]propanamide is sourced from PubChem (CID 65244170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).