N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide

C14H28N2O — CID 107181003

IUPACN-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide
SMILESCCC(N)(CC)CNC(=O)C1CCCC1(C)C
InChIInChI=1S/C14H28N2O/c1-5-14(15,6-2)10-16-12(17)11-8-7-9-13(11,3)4/h11H,5-10,15H2,1-4H3,(H,16,17)
InChIKeyYIUBVBUHWICPFU-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.45
Rot. Bonds5

About N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide

N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide (PubChem CID 107181003) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide
PubChem CID107181003
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide
SMILESCCC(N)(CC)CNC(=O)C1CCCC1(C)C
InChIInChI=1S/C14H28N2O/c1-5-14(15,6-2)10-16-12(17)11-8-7-9-13(11,3)4/h11H,5-10,15H2,1-4H3,(H,16,17)
InChIKeyYIUBVBUHWICPFU-UHFFFAOYSA-N
XLogP2.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(2,2-dimethylcyclohexanecarbonyl)amino]methyl]-2-ethylbutanoic acid
CID 107175829
N-(2,3-dihydroxy-2-methylpropyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107180415
N-(4-amino-2,2-dimethylbutyl)-2,2-dimethylcyclohexane-1-carboxamide
CID 114148900
N-(2-amino-2-ethylbutyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 81484556
N-(5-hydroxy-2,2-dimethylpentyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 104920590
N-(2-amino-2-ethylbutyl)cycloheptanecarboxamide
CID 81484905
N-(2-amino-2-ethylbutyl)cycloheptanecarboxamide;hydrochloride
CID 119643055
N-(2-cyano-2-methylpropyl)-2,2-dimethylcyclohexane-1-carboxamide
CID 107178617
N-(2-amino-2-ethylbutyl)bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 119640656
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 107184438
N-(2-bromoprop-2-enyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 104917114
2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide
CID 107182865

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide (CID 107181003) is N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide is CCC(N)(CC)CNC(=O)C1CCCC1(C)C.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide?
The InChIKey is YIUBVBUHWICPFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-14(15,6-2)10-16-12(17)11-8-7-9-13(11,3)4/h11H,5-10,15H2,1-4H3,(H,16,17).
What are the key properties of N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide?
N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide is sourced from PubChem (CID 107181003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).