3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide

C14H23N3OS — CID 61274579

IUPAC3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide
SMILESCN(C)C(CNC(=O)CCNC1CC1)c1cccs1
InChIInChI=1S/C14H23N3OS/c1-17(2)12(13-4-3-9-19-13)10-16-14(18)7-8-15-11-5-6-11/h3-4,9,11-12,15H,5-8,10H2,1-2H3,(H,16,18)
InChIKeyRQDHEMQPGFOXKK-UHFFFAOYSA-N
MW281.42 g/mol
LogP1.61
Rot. Bonds8

About 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide

3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide (PubChem CID 61274579) has the molecular formula C14H23N3OS and a molecular weight of 281.42 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide
PubChem CID61274579
Molecular FormulaC14H23N3OS
Molecular Weight281.42 g/mol
Exact Mass281.16
IUPAC Name3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide
SMILESCN(C)C(CNC(=O)CCNC1CC1)c1cccs1
InChIInChI=1S/C14H23N3OS/c1-17(2)12(13-4-3-9-19-13)10-16-14(18)7-8-15-11-5-6-11/h3-4,9,11-12,15H,5-8,10H2,1-2H3,(H,16,18)
InChIKeyRQDHEMQPGFOXKK-UHFFFAOYSA-N
XLogP1.61
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)-2-thiophen-2-ylethyl]butanamide
CID 51072640
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-4-hydroxypentanamide
CID 79200485
N-[3-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-3-oxopropyl]benzamide
CID 18161704
3-(cyclopropylamino)-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 81408603
2-cyclohexyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 46522897
3-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-3-oxopropanoic acid
CID 62230106
3-(cyclopropylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)propanamide
CID 60866044
N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 51710563
ethyl 4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-4-oxobutanoate
CID 60636693
1-cyclohexyl-3-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]urea
CID 30834300
1-[4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]piperidin-1-yl]ethanone
CID 43223422
N-[4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-4-oxobutyl]benzamide
CID 51181102

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide?
The IUPAC name of 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide (CID 61274579) is 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide is CN(C)C(CNC(=O)CCNC1CC1)c1cccs1.
What is the InChIKey of 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide?
The InChIKey is RQDHEMQPGFOXKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3OS/c1-17(2)12(13-4-3-9-19-13)10-16-14(18)7-8-15-11-5-6-11/h3-4,9,11-12,15H,5-8,10H2,1-2H3,(H,16,18).
What are the key properties of 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide?
3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide has a molecular weight of 281.42 g/mol, XLogP of 1.61, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]propanamide is sourced from PubChem (CID 61274579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).