N,1,2,5-tetramethylpyrrolidine-3-carboxamide

C9H18N2O — CID 21334864

IUPACN,1,2,5-tetramethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1CC(C)N(C)C1C
InChIInChI=1S/C9H18N2O/c1-6-5-8(9(12)10-3)7(2)11(6)4/h6-8H,5H2,1-4H3,(H,10,12)
InChIKeyAPANNOLFYQOBKU-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.46
Rot. Bonds1

About N,1,2,5-tetramethylpyrrolidine-3-carboxamide

N,1,2,5-tetramethylpyrrolidine-3-carboxamide (PubChem CID 21334864) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N,1,2,5-tetramethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN,1,2,5-tetramethylpyrrolidine-3-carboxamide
PubChem CID21334864
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN,1,2,5-tetramethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1CC(C)N(C)C1C
InChIInChI=1S/C9H18N2O/c1-6-5-8(9(12)10-3)7(2)11(6)4/h6-8H,5H2,1-4H3,(H,10,12)
InChIKeyAPANNOLFYQOBKU-UHFFFAOYSA-N
XLogP0.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylcarbamoyl)cyclopropane-1-carboxylic acid
CID 45084193
N,1,4-trimethylpyrrolidine-3-carboxamide
CID 126994879
cis-(1R,2R)-2-fluoro-N-methylcyclopropane-1-carboxamide
CID 118178176
N-methyl-2-(methylamino)cyclopropane-1-carboxamide
CID 134458689
cis-(1R,2S)-2-acetyl-N-methylcyclopropane-1-carboxamide
CID 89112285
1,2,3,6-tetramethylpiperidin-4-ol
CID 130123560
(1R,2S,5R)-N,5-dimethyl-2-propan-2-ylcyclohexane-1-carboxamide
CID 58330084
cis-(1R,2S)-2-(4-bromophenyl)-N-methylcyclopropane-1-carboxamide
CID 129348369
6-amino-N,7,11-trimethyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradecane-5-carboxamide
CID 163139096
2-chloro-N-methylcyclopentane-1-carboxamide
CID 170236386
(2R,3R,5R)-2,3,4,5-tetrahydroxy-N-methylcyclohexane-1-carboxamide
CID 91283477
(3S,4R)-N,4-dimethylpyrrolidine-3-carboxamide
CID 166890060

Frequently Asked Questions

What is the IUPAC name of N,1,2,5-tetramethylpyrrolidine-3-carboxamide?
The IUPAC name of N,1,2,5-tetramethylpyrrolidine-3-carboxamide (CID 21334864) is N,1,2,5-tetramethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N,1,2,5-tetramethylpyrrolidine-3-carboxamide?
The canonical SMILES for N,1,2,5-tetramethylpyrrolidine-3-carboxamide is CNC(=O)C1CC(C)N(C)C1C.
What is the InChIKey of N,1,2,5-tetramethylpyrrolidine-3-carboxamide?
The InChIKey is APANNOLFYQOBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-6-5-8(9(12)10-3)7(2)11(6)4/h6-8H,5H2,1-4H3,(H,10,12).
What are the key properties of N,1,2,5-tetramethylpyrrolidine-3-carboxamide?
N,1,2,5-tetramethylpyrrolidine-3-carboxamide has a molecular weight of 170.26 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,2,5-tetramethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 21334864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).