N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine

C18H38N2 — CID 79865911

IUPACN-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1C(CN(CC)CC(CC)CC)CCC1(C)C
InChIInChI=1S/C18H38N2/c1-7-15(8-2)13-20(10-4)14-16-11-12-18(5,6)17(16)19-9-3/h15-17,19H,7-14H2,1-6H3
InChIKeySXUZAVWBIIKYOP-UHFFFAOYSA-N
MW282.52 g/mol
LogP4.16
Rot. Bonds9

About N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine

N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine (PubChem CID 79865911) has the molecular formula C18H38N2 and a molecular weight of 282.52 g/mol. Its IUPAC name is N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
PubChem CID79865911
Molecular FormulaC18H38N2
Molecular Weight282.52 g/mol
Exact Mass282.30
IUPAC NameN-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
SMILESCCNC1C(CN(CC)CC(CC)CC)CCC1(C)C
InChIInChI=1S/C18H38N2/c1-7-15(8-2)13-20(10-4)14-16-11-12-18(5,6)17(16)19-9-3/h15-17,19H,7-14H2,1-6H3
InChIKeySXUZAVWBIIKYOP-UHFFFAOYSA-N
XLogP4.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.52
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine with MolForge

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Related Compounds

N-ethyl-6-[[ethyl(2-methylpropyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79853430
N-ethyl-2,2-dimethyl-5-[[methyl(2-methylbutyl)amino]methyl]cyclopentan-1-amine
CID 79865601
N-ethyl-6-[[ethyl(propyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79853175
N-ethyl-5-[[ethyl(thiophen-2-ylmethyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79866036
N-ethyl-6-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79853442
5-[[butyl(methyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 79867055
5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 79855110
5-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79867191
N-ethyl-2,2-dimethyl-6-[[methyl(2-methylbutyl)amino]methyl]cyclohexan-1-amine
CID 79853433
N-ethyl-2,2-dimethyl-6-[[methyl(2-methylpropyl)amino]methyl]cyclohexan-1-amine
CID 79852388
3-[[[2-(ethylamino)-3,3-dimethylcyclopentyl]methyl-methylamino]methyl]cyclobutan-1-ol
CID 79855728
1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl-methylamino]propan-2-ol
CID 79855488

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine?
The IUPAC name of N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine (CID 79865911) is N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine?
The canonical SMILES for N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine is CCNC1C(CN(CC)CC(CC)CC)CCC1(C)C.
What is the InChIKey of N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine?
The InChIKey is SXUZAVWBIIKYOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2/c1-7-15(8-2)13-20(10-4)14-16-11-12-18(5,6)17(16)19-9-3/h15-17,19H,7-14H2,1-6H3.
What are the key properties of N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine?
N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine has a molecular weight of 282.52 g/mol, XLogP of 4.16, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-[[ethyl(2-ethylbutyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79865911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).