N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide

C15H26N2OS — CID 78963769

IUPACN-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide
SMILESCC(C)CNC(=O)C(C)NCC(C)(C)c1cccs1
InChIInChI=1S/C15H26N2OS/c1-11(2)9-16-14(18)12(3)17-10-15(4,5)13-7-6-8-19-13/h6-8,11-12,17H,9-10H2,1-5H3,(H,16,18)
InChIKeyXOVJYWIVBDMESG-UHFFFAOYSA-N
MW282.45 g/mol
LogP2.78
Rot. Bonds7

About N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide

N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide (PubChem CID 78963769) has the molecular formula C15H26N2OS and a molecular weight of 282.45 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide
PubChem CID78963769
Molecular FormulaC15H26N2OS
Molecular Weight282.45 g/mol
Exact Mass282.18
IUPAC NameN-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide
SMILESCC(C)CNC(=O)C(C)NCC(C)(C)c1cccs1
InChIInChI=1S/C15H26N2OS/c1-11(2)9-16-14(18)12(3)17-10-15(4,5)13-7-6-8-19-13/h6-8,11-12,17H,9-10H2,1-5H3,(H,16,18)
InChIKeyXOVJYWIVBDMESG-UHFFFAOYSA-N
XLogP2.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.45
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylbutyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide
CID 78963907
2-[(2-methyl-2-thiophen-2-ylpropyl)amino]-N-pentylpropanamide
CID 78963633
2-[(2-methyl-2-thiophen-2-ylpropyl)amino]-N-phenylpropanamide
CID 78963148
2-[(2-hydroxy-2-thiophen-2-ylethyl)amino]-N-(2-methylpropyl)propanamide
CID 113407006
2-cyclopropyl-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]acetic acid
CID 103257602
3-methoxy-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanoic acid
CID 103257586
N-(2-methyl-2-thiophen-2-ylpropyl)pentan-3-amine
CID 80526217
methyl 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]butanoate
CID 115353516
2-amino-3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)pentanamide;hydrochloride
CID 119787670
2-[1-[(2-methyl-2-thiophen-2-ylpropyl)amino]ethyl]phenol
CID 80525988
(2R)-2-amino-N-(2-methyl-2-thiophen-2-ylpropyl)-2-phenylacetamide
CID 80527246
3-methyl-N-(2-methylpropyl)-3-thiophen-2-ylbutan-1-amine
CID 79830202

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide?
The IUPAC name of N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide (CID 78963769) is N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide?
The canonical SMILES for N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide is CC(C)CNC(=O)C(C)NCC(C)(C)c1cccs1.
What is the InChIKey of N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide?
The InChIKey is XOVJYWIVBDMESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2OS/c1-11(2)9-16-14(18)12(3)17-10-15(4,5)13-7-6-8-19-13/h6-8,11-12,17H,9-10H2,1-5H3,(H,16,18).
What are the key properties of N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide?
N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide has a molecular weight of 282.45 g/mol, XLogP of 2.78, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]propanamide is sourced from PubChem (CID 78963769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).