N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide

C12H23N3O2 — CID 103109036

IUPACN-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
SMILESCCN(C)C(=O)C(C)NC(=O)C1(C)CCNC1
InChIInChI=1S/C12H23N3O2/c1-5-15(4)10(16)9(2)14-11(17)12(3)6-7-13-8-12/h9,13H,5-8H2,1-4H3,(H,14,17)
InChIKeyHZFUUBPRUYCLRO-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.03
Rot. Bonds4

About N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide

N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide (PubChem CID 103109036) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
PubChem CID103109036
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
SMILESCCN(C)C(=O)C(C)NC(=O)C1(C)CCNC1
InChIInChI=1S/C12H23N3O2/c1-5-15(4)10(16)9(2)14-11(17)12(3)6-7-13-8-12/h9,13H,5-8H2,1-4H3,(H,14,17)
InChIKeyHZFUUBPRUYCLRO-UHFFFAOYSA-N
XLogP-0.03
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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

N-[1-(diethylamino)propan-2-yl]-3-methylpyrrolidine-3-carboxamide;dihydrochloride
CID 119860550
methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate
CID 119781278
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 113266401
1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 103108184
1-carbamothioyl-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cycloheptane-1-carboxamide
CID 103110390
N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 63142112
N-(3,3-dimethylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 104828260
3-methyl-N-(1-methylsulfanylpropan-2-yl)pyrrolidine-3-carboxamide;hydrochloride
CID 119796250
3-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-3-carboxamide
CID 112701745
N,3-dimethyl-N-(4-methylpentan-2-yl)pyrrolidine-3-carboxamide
CID 63143490
3-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
CID 63142239
N-[1-(dimethylamino)-1-oxopropan-2-yl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106979756

Frequently Asked Questions

What is the IUPAC name of N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide (CID 103109036) is N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide is CCN(C)C(=O)C(C)NC(=O)C1(C)CCNC1.
What is the InChIKey of N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide?
The InChIKey is HZFUUBPRUYCLRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-5-15(4)10(16)9(2)14-11(17)12(3)6-7-13-8-12/h9,13H,5-8H2,1-4H3,(H,14,17).
What are the key properties of N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide?
N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 103109036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).