4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide

C13H25N3O — CID 115269134

IUPAC4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide
SMILESCC1(C)CC(N)CN1C(=O)NC1CCCCC1
InChIInChI=1S/C13H25N3O/c1-13(2)8-10(14)9-16(13)12(17)15-11-6-4-3-5-7-11/h10-11H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyNOGDQVKLTKZXQZ-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.84
Rot. Bonds1

About 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide

4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide (PubChem CID 115269134) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide
PubChem CID115269134
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide
SMILESCC1(C)CC(N)CN1C(=O)NC1CCCCC1
InChIInChI=1S/C13H25N3O/c1-13(2)8-10(14)9-16(13)12(17)15-11-6-4-3-5-7-11/h10-11H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyNOGDQVKLTKZXQZ-UHFFFAOYSA-N
XLogP1.84
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-cyclopropyl-2,2-dimethylpyrrolidine-1-carboxamide
CID 115269144
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CID 79993898
N-cyclohexyl-5,5-dimethyl-2-(4-methylphenyl)morpholine-4-carboxamide
CID 110327448
(3R)-3-amino-N-cyclopentylpyrrolidine-1-carboxamide
CID 115301653
1-(4-amino-2,2-dimethylpyrrolidin-1-yl)-4-cyclopentylbutan-1-one
CID 115275751
3-amino-N-cyclohexyl-8-azabicyclo[3.2.1]octane-8-carboxamide
CID 61235917
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
(3S,5S)-N-cyclohexyl-3,5-dimethylpiperidine-1-carboxamide
CID 1332142
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
3-(aminomethyl)-N-cyclohexylpyrrolidine-1-carboxamide
CID 62061626
2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide
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1-(4-amino-2,2-dimethylpiperidin-1-yl)propan-1-one
CID 83696910

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide?
The IUPAC name of 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide (CID 115269134) is 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide.
What is the SMILES notation for 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide?
The canonical SMILES for 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide is CC1(C)CC(N)CN1C(=O)NC1CCCCC1.
What is the InChIKey of 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide?
The InChIKey is NOGDQVKLTKZXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-13(2)8-10(14)9-16(13)12(17)15-11-6-4-3-5-7-11/h10-11H,3-9,14H2,1-2H3,(H,15,17).
What are the key properties of 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide?
4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 1.84, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclohexyl-2,2-dimethylpyrrolidine-1-carboxamide is sourced from PubChem (CID 115269134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).