2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide

C8H17N3O — CID 81460239

IUPAC2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide
SMILESCC1CNCC1N(C)CC(N)=O
InChIInChI=1S/C8H17N3O/c1-6-3-10-4-7(6)11(2)5-8(9)12/h6-7,10H,3-5H2,1-2H3,(H2,9,12)
InChIKeyJJAXZMLALCPYSJ-UHFFFAOYSA-N
MW171.24 g/mol
LogP-0.99
Rot. Bonds3

About 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide

2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide (PubChem CID 81460239) has the molecular formula C8H17N3O and a molecular weight of 171.24 g/mol. Its IUPAC name is 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide.

Molecular Properties

Compound Name2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide
PubChem CID81460239
Molecular FormulaC8H17N3O
Molecular Weight171.24 g/mol
Exact Mass171.14
IUPAC Name2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide
SMILESCC1CNCC1N(C)CC(N)=O
InChIInChI=1S/C8H17N3O/c1-6-3-10-4-7(6)11(2)5-8(9)12/h6-7,10H,3-5H2,1-2H3,(H2,9,12)
InChIKeyJJAXZMLALCPYSJ-UHFFFAOYSA-N
XLogP-0.99
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 5-0.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-methylpropyl-(4-methylpyrrolidin-3-yl)amino]acetamide
CID 81459632
(4S)-N,N,4-trimethylpyrrolidin-3-amine
CID 142439406
2-[(1,4-dimethylpyrrolidin-3-yl)-methylamino]acetamide
CID 130678472
N-methyl-3-[methyl-(4-methylpyrrolidin-3-yl)amino]propanamide
CID 106918820
N-(2,2-dimethylpropyl)-N,4-dimethylpyrrolidin-3-amine
CID 81459485
N-(2-amino-2-oxoethyl)-N-ethyl-4-methylpyrrolidine-3-carboxamide
CID 103101983
N-(2-amino-2-oxoethyl)-4-methyl-N-propan-2-ylpyrrolidine-3-carboxamide
CID 63714593
tert-butyl-(4-methylpyrrolidin-3-yl)carbamic acid
CID 146156377
(3S,4S)-N-(2-amino-2-oxoethyl)-N-cyclopentyl-4-methylpyrrolidine-3-carboxamide
CID 114084796
2-[cyclohexyl(methyl)amino]acetamide
CID 22200523
N-methyl-2-[(4-methylpyrrolidin-3-yl)-propylamino]acetamide
CID 81459217
N-(2-amino-2-oxoethyl)-N-ethylazetidine-3-carboxamide
CID 103101813

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide?
The IUPAC name of 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide (CID 81460239) is 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide.
What is the SMILES notation for 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide?
The canonical SMILES for 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide is CC1CNCC1N(C)CC(N)=O.
What is the InChIKey of 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide?
The InChIKey is JJAXZMLALCPYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O/c1-6-3-10-4-7(6)11(2)5-8(9)12/h6-7,10H,3-5H2,1-2H3,(H2,9,12).
What are the key properties of 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide?
2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide has a molecular weight of 171.24 g/mol, XLogP of -0.99, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(4-methylpyrrolidin-3-yl)amino]acetamide is sourced from PubChem (CID 81460239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).