N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine

C11H23N — CID 143174060

IUPACN-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine
SMILESCCN(C)CC1(CC)CC(C)C1
InChIInChI=1S/C11H23N/c1-5-11(7-10(3)8-11)9-12(4)6-2/h10H,5-9H2,1-4H3
InChIKeyZCEQKIUTHDVENL-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.76
Rot. Bonds4

About N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine

N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine (PubChem CID 143174060) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine.

Molecular Properties

Compound NameN-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine
PubChem CID143174060
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine
SMILESCCN(C)CC1(CC)CC(C)C1
InChIInChI=1S/C11H23N/c1-5-11(7-10(3)8-11)9-12(4)6-2/h10H,5-9H2,1-4H3
InChIKeyZCEQKIUTHDVENL-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Diethyl-(2-methyl-hexyl)-amine
CID 21965431
n,n,3,3-Tetramethylheptan-1-amine
CID 256478
N,N-diethyl-2-(1-fluoroethyl)-2-methylpentan-1-amine
CID 123257816
N,N,2-tripropylpentan-1-amine
CID 144637674
2-(Fluoromethyl)-7-(2-methylpropyl)-7-azaspiro[3.5]nonane
CID 155739562
1-[(3-Ethyl-1-methylcyclobutyl)methyl]-3-fluoro-3-methylazetidine
CID 156216313
7-(2-Fluoroethyl)-2-methyl-7-azaspiro[3.5]nonane
CID 167041008
N-ethyl-2-(1-ethylcyclobutyl)-N-fluoroethanamine
CID 167122164
2-Ethyl-6-(2-fluoro-2-methylpropyl)-6-azaspiro[3.4]octane
CID 170740035
6-Fluoro-6-propan-2-yl-2-propyl-2-azaspiro[3.3]heptane
CID 177032145
N,N,2-triethylhexan-1-amine
CID 222428
(5,5-Dimethyl-hexyl)-diethyl-amine
CID 12031214

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine?
The IUPAC name of N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine (CID 143174060) is N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine.
What is the SMILES notation for N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine?
The canonical SMILES for N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine is CCN(C)CC1(CC)CC(C)C1.
What is the InChIKey of N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine?
The InChIKey is ZCEQKIUTHDVENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-5-11(7-10(3)8-11)9-12(4)6-2/h10H,5-9H2,1-4H3.
What are the key properties of N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine?
N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine has a molecular weight of 169.31 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-3-methylcyclobutyl)methyl]-N-methylethanamine is sourced from PubChem (CID 143174060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).