N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide

C14H26N2O2 — CID 106974973

IUPACN-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)CC2CCCO2)CCCN1
InChIInChI=1S/C14H26N2O2/c1-3-7-14(8-5-9-15-14)13(17)16(2)11-12-6-4-10-18-12/h12,15H,3-11H2,1-2H3
InChIKeyHPKDNLLWRJOOTC-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.55
Rot. Bonds5

About N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide

N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide (PubChem CID 106974973) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide
PubChem CID106974973
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)CC2CCCO2)CCCN1
InChIInChI=1S/C14H26N2O2/c1-3-7-14(8-5-9-15-14)13(17)16(2)11-12-6-4-10-18-12/h12,15H,3-11H2,1-2H3
InChIKeyHPKDNLLWRJOOTC-UHFFFAOYSA-N
XLogP1.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(oxan-2-ylmethyl)-4-propylpiperidine-4-carboxamide
CID 63129141
N,4-dimethyl-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
CID 63122472
N,2-dimethyl-N-(oxan-2-ylmethyl)piperidine-2-carboxamide
CID 113368607
4-methoxy-N-methyl-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
CID 119708795
N,4-dimethyl-N-(oxan-2-ylmethyl)piperidine-4-carboxamide
CID 55178326
N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide
CID 106975276
4-amino-N-methyl-N-(oxolan-2-ylmethyl)oxane-4-carboxamide
CID 115294696
2-[cyclopropyl-(2-propylpyrrolidine-2-carbonyl)amino]acetic acid
CID 106974836
N-methyl-N-(3-methylcyclohexyl)-2-propylpyrrolidine-2-carboxamide
CID 106974976
methyl(oxolan-2-ylmethyl)carbamic acid
CID 90935828
cyclopentyl-(2-propylpyrrolidin-2-yl)methanone
CID 106976587
N-ethyl-N-(oxolan-2-ylmethyl)-3-propylpyrrolidine-3-carboxamide
CID 63141891

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide (CID 106974973) is N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)N(C)CC2CCCO2)CCCN1.
What is the InChIKey of N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide?
The InChIKey is HPKDNLLWRJOOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-7-14(8-5-9-15-14)13(17)16(2)11-12-6-4-10-18-12/h12,15H,3-11H2,1-2H3.
What are the key properties of N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide?
N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106974973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).