N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide

C15H30N2O — CID 106974598

IUPACN-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)C(C)C(C)(C)C)CCCN1
InChIInChI=1S/C15H30N2O/c1-7-9-15(10-8-11-16-15)13(18)17(6)12(2)14(3,4)5/h12,16H,7-11H2,1-6H3
InChIKeyUDVSOCHXNGAOKD-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.80
Rot. Bonds4

About N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide

N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide (PubChem CID 106974598) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide
PubChem CID106974598
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)C(C)C(C)(C)C)CCCN1
InChIInChI=1S/C15H30N2O/c1-7-9-15(10-8-11-16-15)13(18)17(6)12(2)14(3,4)5/h12,16H,7-11H2,1-6H3
InChIKeyUDVSOCHXNGAOKD-UHFFFAOYSA-N
XLogP2.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(1-methylsulfanylpropan-2-yl)-2-propylpyrrolidine-2-carboxamide
CID 106975714
N,N-bis(2-methylpropyl)-2-propylpyrrolidine-2-carboxamide
CID 106974292
N-propan-2-yl-N,2-dipropylpyrrolidine-2-carboxamide
CID 106974202
2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide
CID 83080860
N-(3,3-dimethylbutan-2-yl)-N-methyl-3-propylpyrrolidine-3-carboxamide
CID 63143489
N-tert-butyl-N-prop-2-enyl-2-propylpyrrolidine-2-carboxamide
CID 106975650
N-[1-(3-chlorophenyl)ethyl]-N-methyl-2-propylpyrrolidine-2-carboxamide
CID 106974771
N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide
CID 106974201
N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide
CID 106975276
N-(3-hydroxypropyl)-N-propan-2-yl-2-propylpyrrolidine-2-carboxamide
CID 106974762
N-methyl-N-(1-propan-2-ylpiperidin-4-yl)-2-propylpyrrolidine-2-carboxamide
CID 106974576
N-(1-cyclopropylethyl)-2-propyl-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 106974581

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide (CID 106974598) is N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)N(C)C(C)C(C)(C)C)CCCN1.
What is the InChIKey of N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide?
The InChIKey is UDVSOCHXNGAOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-7-9-15(10-8-11-16-15)13(18)17(6)12(2)14(3,4)5/h12,16H,7-11H2,1-6H3.
What are the key properties of N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide?
N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide has a molecular weight of 254.42 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106974598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).