N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide

C12H20N2OS — CID 43398665

IUPACN-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide
SMILESCC(C)NC(=O)C(C)NC(C)c1cccs1
InChIInChI=1S/C12H20N2OS/c1-8(2)13-12(15)10(4)14-9(3)11-6-5-7-16-11/h5-10,14H,1-4H3,(H,13,15)
InChIKeyKOLJCSZKYHEBPM-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.31
Rot. Bonds5

About N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide

N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide (PubChem CID 43398665) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide
PubChem CID43398665
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC NameN-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide
SMILESCC(C)NC(=O)C(C)NC(C)c1cccs1
InChIInChI=1S/C12H20N2OS/c1-8(2)13-12(15)10(4)14-9(3)11-6-5-7-16-11/h5-10,14H,1-4H3,(H,13,15)
InChIKeyKOLJCSZKYHEBPM-UHFFFAOYSA-N
XLogP2.31
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[[(1S)-1-thiophen-2-ylethyl]amino]propanamide
CID 81408171
N-pentan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide
CID 43420221
N-(3-methylbutyl)-2-[[(1S)-1-thiophen-2-ylethyl]amino]propanamide
CID 81409142
1-pyrrolidin-1-yl-2-(1-thiophen-2-ylethylamino)propan-1-one
CID 43397992
N-propan-2-yl-2-(1-thiophen-2-ylpropan-2-ylamino)propanamide
CID 63291724
tert-butyl 2-(1-thiophen-2-ylethylamino)propanoate
CID 64686931
(2R)-2-[[(1S)-1-thiophen-2-ylethyl]amino]-N-(2,2,2-trifluoroethylcarbamoyl)propanamide
CID 124625732
methyl-[2-oxo-2-(propan-2-ylamino)ethyl]-[2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]azanium
CID 8913554
2,2-dimethyl-N-[(1R)-1-thiophen-2-ylethyl]propanamide
CID 81408910
N-propan-2-yl-3-thiophen-2-ylbutanamide
CID 175911006
N-[(1R)-1-thiophen-2-ylethyl]prop-2-enamide
CID 81408740
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-propan-2-ylpropanamide
CID 81378852

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide?
The IUPAC name of N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide (CID 43398665) is N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide.
What is the SMILES notation for N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide?
The canonical SMILES for N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide is CC(C)NC(=O)C(C)NC(C)c1cccs1.
What is the InChIKey of N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide?
The InChIKey is KOLJCSZKYHEBPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-8(2)13-12(15)10(4)14-9(3)11-6-5-7-16-11/h5-10,14H,1-4H3,(H,13,15).
What are the key properties of N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide?
N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide has a molecular weight of 240.37 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide is sourced from PubChem (CID 43398665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).