N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide

C11H22N2O2 — CID 63142112

IUPACN-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
SMILESCCOCC(C)NC(=O)C1(C)CCNC1
InChIInChI=1S/C11H22N2O2/c1-4-15-7-9(2)13-10(14)11(3)5-6-12-8-11/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyRHNBQXKOIKCOBF-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.53
Rot. Bonds5

About N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide

N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide (PubChem CID 63142112) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
PubChem CID63142112
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
SMILESCCOCC(C)NC(=O)C1(C)CCNC1
InChIInChI=1S/C11H22N2O2/c1-4-15-7-9(2)13-10(14)11(3)5-6-12-8-11/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyRHNBQXKOIKCOBF-UHFFFAOYSA-N
XLogP0.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.53
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
3-methyl-N-(1-methylsulfanylpropan-2-yl)pyrrolidine-3-carboxamide;hydrochloride
CID 119796250
3-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
CID 63142239
methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate
CID 119781278
N-(1-ethoxy-3-methylbutan-2-yl)-3-ethylpyrrolidine-3-carboxamide
CID 114113787
N-(3,3-dimethylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 104828260
N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 103109036
3-methyl-N-[1-(2-methylphenyl)propan-2-yl]pyrrolidine-3-carboxamide
CID 55165528
1-amino-N-(1-ethoxypropan-2-yl)cyclobutane-1-carboxamide
CID 81168256
3-methyl-N-[3-(2-methylpropoxy)propyl]pyrrolidine-3-carboxamide
CID 55165905
N-[(1R)-1-cyclopentylethyl]-3-methylpyrrolidine-3-carboxamide
CID 81388379
N-[3-(butan-2-ylamino)-3-oxopropyl]-3-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119737579

Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide (CID 63142112) is N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide is CCOCC(C)NC(=O)C1(C)CCNC1.
What is the InChIKey of N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The InChIKey is RHNBQXKOIKCOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-15-7-9(2)13-10(14)11(3)5-6-12-8-11/h9,12H,4-8H2,1-3H3,(H,13,14).
What are the key properties of N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63142112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).