N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide

C15H31N3O — CID 107423973

IUPACN,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
SMILESCCCCN(CCCC)C(=O)CNC1(C)CCNC1
InChIInChI=1S/C15H31N3O/c1-4-6-10-18(11-7-5-2)14(19)12-17-15(3)8-9-16-13-15/h16-17H,4-13H2,1-3H3
InChIKeyWZQCBXZYUPMAQO-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.76
Rot. Bonds9

About N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide

N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide (PubChem CID 107423973) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
PubChem CID107423973
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
SMILESCCCCN(CCCC)C(=O)CNC1(C)CCNC1
InChIInChI=1S/C15H31N3O/c1-4-6-10-18(11-7-5-2)14(19)12-17-15(3)8-9-16-13-15/h16-17H,4-13H2,1-3H3
InChIKeyWZQCBXZYUPMAQO-UHFFFAOYSA-N
XLogP1.76
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylpyrrolidin-3-yl)decanamide
CID 107422812
N-ethyl-3-methylpyrrolidin-3-amine
CID 107423762
2-[(3-methylpyrrolidin-3-yl)amino]-1-pyrrolidin-1-ylethanone
CID 107424618
2-ethoxy-N-(3-methylpyrrolidin-3-yl)acetamide
CID 107422673
2-[(3-methylpyrrolidin-3-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 107424383
3-methyl-N-(2-methylbutyl)pyrrolidin-3-amine
CID 107424428
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
CID 107423836
N-butyl-3-ethyl-N-(2-hydroxyethyl)pyrrolidine-3-carboxamide
CID 63143750
N-(5-methyl-1,2-oxazol-3-yl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
CID 107423504
N-butyl-N-(2-hydroxyethyl)-3-methylpiperidine-3-carboxamide
CID 63131141
2-[(3-methylpyrrolidin-3-yl)amino]-N-(3-propan-2-yloxypropyl)acetamide
CID 107424328
N-(3-methylpyrrolidin-3-yl)-3-propoxypropanamide
CID 107422647

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
The IUPAC name of N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide (CID 107423973) is N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide.
What is the SMILES notation for N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
The canonical SMILES for N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide is CCCCN(CCCC)C(=O)CNC1(C)CCNC1.
What is the InChIKey of N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
The InChIKey is WZQCBXZYUPMAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-4-6-10-18(11-7-5-2)14(19)12-17-15(3)8-9-16-13-15/h16-17H,4-13H2,1-3H3.
What are the key properties of N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide has a molecular weight of 269.43 g/mol, XLogP of 1.76, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-2-[(3-methylpyrrolidin-3-yl)amino]acetamide is sourced from PubChem (CID 107423973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).