2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride

C11H17ClN2OS — CID 119276253

IUPAC2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride
SMILESCC(N)C(=O)NC(c1cccs1)C1CC1.Cl
InChIInChI=1S/C11H16N2OS.ClH/c1-7(12)11(14)13-10(8-4-5-8)9-3-2-6-15-9;/h2-3,6-8,10H,4-5,12H2,1H3,(H,13,14);1H
InChIKeyTZBQMZSRDXFBFS-UHFFFAOYSA-N
MW260.79 g/mol
LogP2.08
Rot. Bonds4

About 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride

2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride (PubChem CID 119276253) has the molecular formula C11H17ClN2OS and a molecular weight of 260.79 g/mol. Its IUPAC name is 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride
PubChem CID119276253
Molecular FormulaC11H17ClN2OS
Molecular Weight260.79 g/mol
Exact Mass260.08
IUPAC Name2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride
SMILESCC(N)C(=O)NC(c1cccs1)C1CC1.Cl
InChIInChI=1S/C11H16N2OS.ClH/c1-7(12)11(14)13-10(8-4-5-8)9-3-2-6-15-9;/h2-3,6-8,10H,4-5,12H2,1H3,(H,13,14);1H
InChIKeyTZBQMZSRDXFBFS-UHFFFAOYSA-N
XLogP2.08
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.79
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxypropanamide
CID 47307968
N-[(2S)-1-[[(S)-cyclopentyl(thiophen-2-yl)methyl]amino]-1-oxopropan-2-yl]thiophene-2-carboxamide
CID 39612740
1-[(R)-cyclopentyl(thiophen-2-yl)methyl]-3-methylurea
CID 94152755
N-[(R)-cyclopentyl(thiophen-2-yl)methyl]thiophene-2-carboxamide
CID 39032304
2-amino-N-(dicyclopropylmethyl)-2-thiophen-2-ylacetamide
CID 115286946
N-[cyclopropyl(thiophen-2-yl)methyl]propan-2-amine
CID 60713978
2-amino-N-[(1R)-1-cycloheptylethyl]-2-thiophen-2-ylacetamide
CID 115287598
4-amino-N-[(1R)-1-thiophen-2-ylethyl]cyclohexane-1-carboxamide
CID 81408620
methyl 2-[[cyclopropyl(thiophen-2-yl)methyl]amino]acetate
CID 60714004
N-[cyclopentyl(thiophen-2-yl)methyl]piperidine-4-carboxamide
CID 43697912
2-amino-2-(oxan-4-yl)-N-(1-thiophen-2-ylethyl)acetamide
CID 120784158
2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
CID 78987130

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride?
The IUPAC name of 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride (CID 119276253) is 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride is CC(N)C(=O)NC(c1cccs1)C1CC1.Cl.
What is the InChIKey of 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride?
The InChIKey is TZBQMZSRDXFBFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS.ClH/c1-7(12)11(14)13-10(8-4-5-8)9-3-2-6-15-9;/h2-3,6-8,10H,4-5,12H2,1H3,(H,13,14);1H.
What are the key properties of 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride?
2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride has a molecular weight of 260.79 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride is sourced from PubChem (CID 119276253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).