N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide

C13H27N3O — CID 103188683

IUPACN-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide
SMILESCCN(C(=O)C1NCCC1C)C(C)CN(C)C
InChIInChI=1S/C13H27N3O/c1-6-16(11(3)9-15(4)5)13(17)12-10(2)7-8-14-12/h10-12,14H,6-9H2,1-5H3
InChIKeyBPMZDERBFPFIIU-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.78
Rot. Bonds5

About N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide

N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide (PubChem CID 103188683) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide
PubChem CID103188683
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide
SMILESCCN(C(=O)C1NCCC1C)C(C)CN(C)C
InChIInChI=1S/C13H27N3O/c1-6-16(11(3)9-15(4)5)13(17)12-10(2)7-8-14-12/h10-12,14H,6-9H2,1-5H3
InChIKeyBPMZDERBFPFIIU-UHFFFAOYSA-N
XLogP0.78
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrrolidine-2-carboxamide
CID 102778679
N-[1-(dimethylamino)propan-2-yl]-N,4-diethylpiperidine-2-carboxamide
CID 103188614
N-(cyclopropylmethyl)-3-methyl-N-propan-2-ylpyrrolidine-2-carboxamide
CID 102779238
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-6-methylpiperidine-3-carboxamide
CID 103189088
N-(1-cyclopropylethyl)-N,3-dimethylpyrrolidine-2-carboxamide
CID 102777396
N-ethyl-3-methyl-N-propylpyrrolidine-2-carboxamide
CID 102777244
N-[2-(dimethylamino)ethyl]-3-methyl-N-propylpyrrolidine-2-carboxamide
CID 102779290
ethyl 2-[2-methylpropyl-(3-methylpyrrolidine-2-carbonyl)amino]acetate
CID 102778708
N-(3,3-dimethylbutan-2-yl)-N,3-dimethylpyrrolidine-2-carboxamide
CID 102778623
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-3-methylpiperidine-2-carboxamide
CID 107067743
N-butan-2-yl-3-methylpyrrolidine-2-carboxamide
CID 102776775
3-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-methylcyclohexane-1-carboxamide
CID 103191959

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide (CID 103188683) is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide is CCN(C(=O)C1NCCC1C)C(C)CN(C)C.
What is the InChIKey of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide?
The InChIKey is BPMZDERBFPFIIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-6-16(11(3)9-15(4)5)13(17)12-10(2)7-8-14-12/h10-12,14H,6-9H2,1-5H3.
What are the key properties of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide?
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide has a molecular weight of 241.38 g/mol, XLogP of 0.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 103188683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).