N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide

C12H23N3O2 — CID 63140406

IUPACN-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide
SMILESCCNC(=O)CN(CC)C(=O)C1(C)CCNC1
InChIInChI=1S/C12H23N3O2/c1-4-14-10(16)8-15(5-2)11(17)12(3)6-7-13-9-12/h13H,4-9H2,1-3H3,(H,14,16)
InChIKeyANWVYYIGEBWDOC-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.03
Rot. Bonds5

About N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide

N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide (PubChem CID 63140406) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide
PubChem CID63140406
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide
SMILESCCNC(=O)CN(CC)C(=O)C1(C)CCNC1
InChIInChI=1S/C12H23N3O2/c1-4-14-10(16)8-15(5-2)11(17)12(3)6-7-13-9-12/h13H,4-9H2,1-3H3,(H,14,16)
InChIKeyANWVYYIGEBWDOC-UHFFFAOYSA-N
XLogP-0.03
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl-(3-methylpyrrolidine-3-carbonyl)amino]acetic acid
CID 63142548
N-ethyl-N-(2-hydroxyethyl)-3-methylpyrrolidine-3-carboxamide
CID 63143706
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-propylpiperidine-3-carboxamide
CID 63130724
N-ethyl-3-methyl-N-prop-2-enylpyrrolidine-3-carboxamide
CID 81489802
1-amino-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide
CID 65465097
methyl 2-[(3-methylpyrrolidine-3-carbonyl)-propylamino]acetate
CID 63143757
3-[ethyl-(3-methylpyrrolidine-3-carbonyl)amino]-2-methylpropanoic acid
CID 63142000
tert-butyl 4-[ethyl-[2-(ethylamino)-2-oxoethyl]carbamoyl]-4-methylpiperidine-1-carboxylate
CID 71911150
N-ethyl-4-methyl-N-(2-methylprop-2-enyl)piperidine-4-carboxamide
CID 63121302
N-[2-(dimethylamino)-2-oxoethyl]-N-ethyl-4-methylpiperidine-4-carboxamide
CID 63121817
N-(cyclopropylmethyl)-3-methyl-N-propylpyrrolidine-3-carboxamide
CID 63138956
2-amino-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-1-methylcyclopentane-1-carboxamide
CID 82763783

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide (CID 63140406) is N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide is CCNC(=O)CN(CC)C(=O)C1(C)CCNC1.
What is the InChIKey of N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide?
The InChIKey is ANWVYYIGEBWDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-14-10(16)8-15(5-2)11(17)12(3)6-7-13-9-12/h13H,4-9H2,1-3H3,(H,14,16).
What are the key properties of N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide?
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63140406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).