N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide

C15H31N3O2 — CID 63143867

IUPACN-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)N(CCCN(C)C)CCOC)CCNC1
InChIInChI=1S/C15H31N3O2/c1-5-15(7-8-16-13-15)14(19)18(11-12-20-4)10-6-9-17(2)3/h16H,5-13H2,1-4H3
InChIKeyKFULIXORQXSYDM-UHFFFAOYSA-N
MW285.43 g/mol
LogP0.80
Rot. Bonds9

About N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide

N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide (PubChem CID 63143867) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
PubChem CID63143867
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC NameN-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)N(CCCN(C)C)CCOC)CCNC1
InChIInChI=1S/C15H31N3O2/c1-5-15(7-8-16-13-15)14(19)18(11-12-20-4)10-6-9-17(2)3/h16H,5-13H2,1-4H3
InChIKeyKFULIXORQXSYDM-UHFFFAOYSA-N
XLogP0.80
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 115435074
1-(aminomethyl)-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)cyclopropane-1-carboxamide
CID 113312882
N-butyl-3-ethyl-N-(2-hydroxyethyl)pyrrolidine-3-carboxamide
CID 63143750
N-(2-ethoxyethyl)-N,3-diethylpyrrolidine-3-carboxamide
CID 63692883
N,N-bis(2-ethoxyethyl)-4-ethylpiperidine-4-carboxamide
CID 82960199
N,N-bis(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63130592
N-(1,1-dioxothiolan-3-yl)-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
CID 63139877
N,N-bis(cyanomethyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140597
N-cyclopropyl-4-ethyl-N-(2-methoxyethyl)piperidine-4-carboxamide
CID 63128216
N,N-bis(2-methoxyethyl)-4-methylpiperidine-4-carboxamide
CID 55179285
N-[3-(diethylamino)propyl]-N,4-diethylpiperidine-4-carboxamide
CID 102993130
2-[2-(2-methoxyethoxy)ethoxy]ethyl 3-ethylpyrrolidine-3-carboxylate
CID 104562939

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide (CID 63143867) is N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide is CCC1(C(=O)N(CCCN(C)C)CCOC)CCNC1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide?
The InChIKey is KFULIXORQXSYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-5-15(7-8-16-13-15)14(19)18(11-12-20-4)10-6-9-17(2)3/h16H,5-13H2,1-4H3.
What are the key properties of N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide?
N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide has a molecular weight of 285.43 g/mol, XLogP of 0.80, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 63143867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).