N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide

C9H19N3O — CID 61462384

IUPACN,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide
SMILESCN1CCC(NCC(=O)N(C)C)C1
InChIInChI=1S/C9H19N3O/c1-11(2)9(13)6-10-8-4-5-12(3)7-8/h8,10H,4-7H2,1-3H3
InChIKeyCVEBDUORWQKMDD-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.63
Rot. Bonds3

About N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide

N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide (PubChem CID 61462384) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide
PubChem CID61462384
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC NameN,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide
SMILESCN1CCC(NCC(=O)N(C)C)C1
InChIInChI=1S/C9H19N3O/c1-11(2)9(13)6-10-8-4-5-12(3)7-8/h8,10H,4-7H2,1-3H3
InChIKeyCVEBDUORWQKMDD-UHFFFAOYSA-N
XLogP-0.63
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide?
The IUPAC name of N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide (CID 61462384) is N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide is CN1CCC(NCC(=O)N(C)C)C1.
What is the InChIKey of N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide?
The InChIKey is CVEBDUORWQKMDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-11(2)9(13)6-10-8-4-5-12(3)7-8/h8,10H,4-7H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide?
N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide has a molecular weight of 185.27 g/mol, XLogP of -0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide is sourced from PubChem (CID 61462384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).