N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide

C11H23N3O — CID 103824204

IUPACN,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide
SMILESCNC(=O)C(C)(C)CNC1CCN(C)C1
InChIInChI=1S/C11H23N3O/c1-11(2,10(15)12-3)8-13-9-5-6-14(4)7-9/h9,13H,5-8H2,1-4H3,(H,12,15)
InChIKeyBYWRBCLJVLSIKB-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.05
Rot. Bonds4

About N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide

N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide (PubChem CID 103824204) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide
PubChem CID103824204
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC NameN,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide
SMILESCNC(=O)C(C)(C)CNC1CCN(C)C1
InChIInChI=1S/C11H23N3O/c1-11(2,10(15)12-3)8-13-9-5-6-14(4)7-9/h9,13H,5-8H2,1-4H3,(H,12,15)
InChIKeyBYWRBCLJVLSIKB-UHFFFAOYSA-N
XLogP0.05
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-methyl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine
CID 162433689
N,2,2-trimethyl-3-[(3-methylcyclobutyl)amino]propanamide
CID 104859958
2,2-dimethyl-N-[(3S)-1-methylpyrrolidin-3-yl]propanamide
CID 58679843
N,2,2-trimethyl-3-(thiolan-3-ylamino)propanamide
CID 104530421
N-methyl-4-[(1-methylpyrrolidin-3-yl)amino]butanamide
CID 63892267
[(1-methylpyrrolidin-3-yl)amino]methanethiol
CID 115227697
2-[(1-methylpyrrolidin-3-yl)amino]-1-pyrrolidin-1-ylethanone
CID 61462383
3-amino-2,2,3-trimethyl-N-(1-methylpyrrolidin-3-yl)butanamide
CID 65269836
3,3-dimethyl-4-[(1-methylpiperidin-3-yl)amino]butanoic acid
CID 115220242
N,N-dimethyl-2-[(1-methylpyrrolidin-3-yl)amino]acetamide
CID 61462384
3-methyl-2-[[(1-methylpyrrolidin-3-yl)amino]methyl]butanoic acid
CID 115250234
3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide
CID 103917226

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide?
The IUPAC name of N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide (CID 103824204) is N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide.
What is the SMILES notation for N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide?
The canonical SMILES for N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide is CNC(=O)C(C)(C)CNC1CCN(C)C1.
What is the InChIKey of N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide?
The InChIKey is BYWRBCLJVLSIKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-11(2,10(15)12-3)8-13-9-5-6-14(4)7-9/h9,13H,5-8H2,1-4H3,(H,12,15).
What are the key properties of N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide?
N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide has a molecular weight of 213.32 g/mol, XLogP of 0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide is sourced from PubChem (CID 103824204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).