(4S)-4-(ethylamino)-1-methylpyrrolidin-2-one

C7H14N2O — CID 171515243

IUPAC(4S)-4-(ethylamino)-1-methylpyrrolidin-2-one
SMILESCCN[C@H]1CC(=O)N(C)C1
InChIInChI=1S/C7H14N2O/c1-3-8-6-4-7(10)9(2)5-6/h6,8H,3-5H2,1-2H3/t6-/m0/s1
InChIKeyTYOFNWPDQMXFJW-LURJTMIESA-N
MW142.20 g/mol
LogP-0.17
Rot. Bonds2

About (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one

(4S)-4-(ethylamino)-1-methylpyrrolidin-2-one (PubChem CID 171515243) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one.

Molecular Properties

Compound Name(4S)-4-(ethylamino)-1-methylpyrrolidin-2-one
PubChem CID171515243
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name(4S)-4-(ethylamino)-1-methylpyrrolidin-2-one
SMILESCCN[C@H]1CC(=O)N(C)C1
InChIInChI=1S/C7H14N2O/c1-3-8-6-4-7(10)9(2)5-6/h6,8H,3-5H2,1-2H3/t6-/m0/s1
InChIKeyTYOFNWPDQMXFJW-LURJTMIESA-N
XLogP-0.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(ethylamino)-1-methylpiperidin-2-one
CID 146770856
2-ethyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 60616692
1-methyl-4-(1,3-thiazol-5-ylmethylamino)pyrrolidin-2-one
CID 130163196
1-methyl-4-(1-sulfanylethylamino)pyrrolidin-2-one
CID 146921004
4-(1H-imidazol-5-ylmethylamino)-1-methylpyrrolidin-2-one
CID 130804951
3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 110736478
3-chloro-N-(1-methyl-5-oxopyrrolidin-3-yl)propanamide
CID 130585425
N-(1-methyl-5-oxopyrrolidin-3-yl)-3-sulfanylpropanamide
CID 126983919
1-methyl-5-(propylamino)piperidin-2-one
CID 64655123
1-(1-methyl-5-oxopyrrolidin-3-yl)-3-pentylurea
CID 56794755
2-amino-3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)pentanamide
CID 119758230
N-(1-methyl-5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 110736572

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one?
The IUPAC name of (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one (CID 171515243) is (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one.
What is the SMILES notation for (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one?
The canonical SMILES for (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one is CCN[C@H]1CC(=O)N(C)C1.
What is the InChIKey of (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one?
The InChIKey is TYOFNWPDQMXFJW-LURJTMIESA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-8-6-4-7(10)9(2)5-6/h6,8H,3-5H2,1-2H3/t6-/m0/s1.
What are the key properties of (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one?
(4S)-4-(ethylamino)-1-methylpyrrolidin-2-one has a molecular weight of 142.20 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(ethylamino)-1-methylpyrrolidin-2-one is sourced from PubChem (CID 171515243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).