2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide

C10H20N2O2S — CID 81200813

IUPAC2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide
SMILESCC(CN)CS(=O)CC(=O)NCC1CC1
InChIInChI=1S/C10H20N2O2S/c1-8(4-11)6-15(14)7-10(13)12-5-9-2-3-9/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyAMTYASREEMCANE-UHFFFAOYSA-N
MW232.35 g/mol
LogP-0.14
Rot. Bonds7

About 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide

2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide (PubChem CID 81200813) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide
PubChem CID81200813
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC Name2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide
SMILESCC(CN)CS(=O)CC(=O)NCC1CC1
InChIInChI=1S/C10H20N2O2S/c1-8(4-11)6-15(14)7-10(13)12-5-9-2-3-9/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyAMTYASREEMCANE-UHFFFAOYSA-N
XLogP-0.14
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminopropan-2-ylsulfinyl)-N-(cyclopropylmethyl)acetamide
CID 81187710
2-(3-amino-2-methylpropyl)sulfinyl-N-propylacetamide
CID 81201708
2-(3-amino-2-methylpropyl)sulfinyl-N-(2-methoxyethyl)acetamide
CID 81201126
(2R)-2-acetamido-3-[2-(cyclopropylmethylamino)-2-oxoethyl]sulfinylpropanoic acid
CID 107775688
4-amino-3-methyl-N-[(4-methylcyclohexyl)methyl]butanamide
CID 81079716
N-(3-amino-2-methylpropyl)-2-cyclopropylacetamide
CID 62667808
N-[[4-(aminomethyl)cyclohexyl]methyl]-4-methylpentanamide
CID 114231575
3-(aminomethyl)-N-[(4-hydroxycyclohexyl)methyl]-5-methylhexanamide
CID 106135609
3-(cyclohexylmethylsulfinyl)-2-methylpropan-1-amine
CID 81200825
4-amino-3-methyl-N-(thiolan-3-ylmethyl)butanamide
CID 107296156
4-amino-3-methyl-N-(oxolan-3-ylmethyl)butanamide
CID 81075819
2-amino-N-(cyclopropylmethyl)propanamide
CID 24690233

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide?
The IUPAC name of 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide (CID 81200813) is 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide.
What is the SMILES notation for 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide?
The canonical SMILES for 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide is CC(CN)CS(=O)CC(=O)NCC1CC1.
What is the InChIKey of 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide?
The InChIKey is AMTYASREEMCANE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-8(4-11)6-15(14)7-10(13)12-5-9-2-3-9/h8-9H,2-7,11H2,1H3,(H,12,13).
What are the key properties of 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide?
2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide has a molecular weight of 232.35 g/mol, XLogP of -0.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2-methylpropyl)sulfinyl-N-(cyclopropylmethyl)acetamide is sourced from PubChem (CID 81200813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).