N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide

C12H25N3O — CID 106975276

IUPACN-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)CCNC)CCCN1
InChIInChI=1S/C12H25N3O/c1-4-6-12(7-5-8-14-12)11(16)15(3)10-9-13-2/h13-14H,4-10H2,1-3H3
InChIKeyHJJBWQDYWQRPCS-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.59
Rot. Bonds6

About N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide

N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide (PubChem CID 106975276) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide
PubChem CID106975276
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)N(C)CCNC)CCCN1
InChIInChI=1S/C12H25N3O/c1-4-6-12(7-5-8-14-12)11(16)15(3)10-9-13-2/h13-14H,4-10H2,1-3H3
InChIKeyHJJBWQDYWQRPCS-UHFFFAOYSA-N
XLogP0.59
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide
CID 106974201
N-propan-2-yl-N,2-dipropylpyrrolidine-2-carboxamide
CID 106974202
N-methyl-N-(1-methylsulfanylpropan-2-yl)-2-propylpyrrolidine-2-carboxamide
CID 106975714
N,N-bis(2-methylpropyl)-2-propylpyrrolidine-2-carboxamide
CID 106974292
2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide
CID 83071737
N-(3,3-dimethylbutan-2-yl)-N-methyl-2-propylpyrrolidine-2-carboxamide
CID 106974598
methyl (2R)-2-propylpiperidine-2-carboxylate
CID 95169858
N-methyl-N-(oxolan-2-ylmethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974973
N-methyl-N-(4-methylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106975073
N-(3-hydroxypropyl)-N-propan-2-yl-2-propylpyrrolidine-2-carboxamide
CID 106974762
N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-propylpyrrolidine-2-carboxamide
CID 106974588
N-methyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-2-propylpyrrolidine-2-carboxamide
CID 106975311

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide (CID 106975276) is N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)N(C)CCNC)CCCN1.
What is the InChIKey of N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide?
The InChIKey is HJJBWQDYWQRPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-4-6-12(7-5-8-14-12)11(16)15(3)10-9-13-2/h13-14H,4-10H2,1-3H3.
What are the key properties of N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide?
N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide has a molecular weight of 227.35 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106975276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).