2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride

C11H19ClN2OS — CID 119289696

IUPAC2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
SMILESCC(N)C(=O)N(Cc1cccs1)C(C)C.Cl
InChIInChI=1S/C11H18N2OS.ClH/c1-8(2)13(11(14)9(3)12)7-10-5-4-6-15-10;/h4-6,8-9H,7,12H2,1-3H3;1H
InChIKeyDNQURQYOADZDBX-UHFFFAOYSA-N
MW262.81 g/mol
LogP2.25
Rot. Bonds4

About 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride

2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride (PubChem CID 119289696) has the molecular formula C11H19ClN2OS and a molecular weight of 262.81 g/mol. Its IUPAC name is 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
PubChem CID119289696
Molecular FormulaC11H19ClN2OS
Molecular Weight262.81 g/mol
Exact Mass262.09
IUPAC Name2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
SMILESCC(N)C(=O)N(Cc1cccs1)C(C)C.Cl
InChIInChI=1S/C11H18N2OS.ClH/c1-8(2)13(11(14)9(3)12)7-10-5-4-6-15-10;/h4-6,8-9H,7,12H2,1-3H3;1H
InChIKeyDNQURQYOADZDBX-UHFFFAOYSA-N
XLogP2.25
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.81
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-methyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)butanamide
CID 54946987
(2S)-2-amino-N,N-bis(thiophen-2-ylmethyl)propanamide;hydrochloride
CID 119271759
2-(aminomethyl)-3-methyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)butanamide
CID 65228797
2-methoxy-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 112686946
3-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
CID 119289693
2-amino-2-ethyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)butanamide
CID 79814434
1,1-dimethyl-3-propan-2-yl-3-(thiophen-2-ylmethyl)urea
CID 115591362
2-chloro-N-propan-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 39248066
2-amino-2-methyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)pentanamide
CID 54946833
2,2-dimethyl-3-[propan-2-yl(thiophen-2-ylmethyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 64835236
(2R)-2-amino-N,3-dimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 79011600
(2S)-2-amino-N,N-bis(thiophen-2-ylmethyl)butanamide;hydrochloride
CID 119271767

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The IUPAC name of 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride (CID 119289696) is 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The canonical SMILES for 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride is CC(N)C(=O)N(Cc1cccs1)C(C)C.Cl.
What is the InChIKey of 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The InChIKey is DNQURQYOADZDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS.ClH/c1-8(2)13(11(14)9(3)12)7-10-5-4-6-15-10;/h4-6,8-9H,7,12H2,1-3H3;1H.
What are the key properties of 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride has a molecular weight of 262.81 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride is sourced from PubChem (CID 119289696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).