N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C13H26N2O — CID 115737773

IUPACN-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCCCC(N)CNC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C13H26N2O/c1-6-7-9(14)8-15-11(16)10-12(2,3)13(10,4)5/h9-10H,6-8,14H2,1-5H3,(H,15,16)
InChIKeyXVGQJJHGMIBZIU-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.91
Rot. Bonds5

About N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 115737773) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID115737773
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCCCC(N)CNC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C13H26N2O/c1-6-7-9(14)8-15-11(16)10-12(2,3)13(10,4)5/h9-10H,6-8,14H2,1-5H3,(H,15,16)
InChIKeyXVGQJJHGMIBZIU-UHFFFAOYSA-N
XLogP1.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminopentyl)-2-ethylbutanamide
CID 115737781
N-(2-aminopentyl)pentanamide
CID 115737691
(2S)-2-hydroxy-3-[(2,2,3,3-tetramethylcyclopropanecarbonyl)amino]propanoic acid
CID 107833706
N-(2-aminopentyl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 115737763
N-(2-aminopentyl)-2-methylsulfonylpropanamide
CID 115737770
2-aminohexylurea
CID 171485886
1-N-(2-aminopentyl)pentane-1,2-diamine
CID 139611076
N-(2-aminopentyl)-2,6-dihydroxybenzamide
CID 107691454
N-(2-amino-2-ethylbutyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 81484556
N-(2-aminopentyl)-3,5-difluorobenzamide
CID 115737672
N-(2-aminopentyl)pyridine-4-carboxamide
CID 115737712
3-[2-(2-hydroxyethyl)pentylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 114145229

Frequently Asked Questions

What is the IUPAC name of N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 115737773) is N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CCCC(N)CNC(=O)C1C(C)(C)C1(C)C.
What is the InChIKey of N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is XVGQJJHGMIBZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-6-7-9(14)8-15-11(16)10-12(2,3)13(10,4)5/h9-10H,6-8,14H2,1-5H3,(H,15,16).
What are the key properties of N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminopentyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 115737773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).