3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine

C11H23N — CID 152838706

IUPAC3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine
SMILESCCC1(C)CC(C)(NC(C)C)C1
InChIInChI=1S/C11H23N/c1-6-10(4)7-11(5,8-10)12-9(2)3/h9,12H,6-8H2,1-5H3
InChIKeySYFMIPPTOYONDD-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.95
Rot. Bonds3

About 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine

3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine (PubChem CID 152838706) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine.

Molecular Properties

Compound Name3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine
PubChem CID152838706
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine
SMILESCCC1(C)CC(C)(NC(C)C)C1
InChIInChI=1S/C11H23N/c1-6-10(4)7-11(5,8-10)12-9(2)3/h9,12H,6-8H2,1-5H3
InChIKeySYFMIPPTOYONDD-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-N-propan-2-yloxetan-3-amine
CID 58799671
1,1,3-triethyl-3-methylcyclobutane
CID 123991500
4,4-difluoro-1-methyl-N-propan-2-ylcyclohexan-1-amine
CID 58799781
2-butyl-1-methoxy-2-methyl-N-propan-2-ylcyclopropan-1-amine
CID 134907890
4-methyl-1,1-dioxo-N-propan-2-ylthian-4-amine
CID 146946507
6,6-dichloro-3-methyl-N-propan-2-ylbicyclo[3.1.0]hexan-3-amine
CID 58799873
(3S)-3-ethyl-1,3-dimethylcyclopentan-1-amine;methane
CID 143623588
1-ethyl-1,6-dimethyl-6-(3-methylbutyl)cycloundecane
CID 91393597
1-ethyl-1-methylcyclohexane;molecular hydrogen
CID 143091347
1,1-dimethylcyclopropane;1-ethyl-1-methylcyclopropane
CID 143562468
4-ethyl-1-methoxy-2,2,4,6,6-pentamethylpiperidine
CID 54376541
4-ethyl-4-methylazepane
CID 55299291

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine?
The IUPAC name of 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine (CID 152838706) is 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine.
What is the SMILES notation for 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine?
The canonical SMILES for 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine is CCC1(C)CC(C)(NC(C)C)C1.
What is the InChIKey of 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine?
The InChIKey is SYFMIPPTOYONDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-6-10(4)7-11(5,8-10)12-9(2)3/h9,12H,6-8H2,1-5H3.
What are the key properties of 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine?
3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,3-dimethyl-N-propan-2-ylcyclobutan-1-amine is sourced from PubChem (CID 152838706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).