1-(2-ethylcyclopropyl)-N-methylbutan-2-amine

C10H21N — CID 123849930

IUPAC1-(2-ethylcyclopropyl)-N-methylbutan-2-amine
SMILESCCC(CC1CC1CC)NC
InChIInChI=1S/C10H21N/c1-4-8-6-9(8)7-10(5-2)11-3/h8-11H,4-7H2,1-3H3
InChIKeyXCIHCWOAAVAFSO-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.42
Rot. Bonds5

About 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine

1-(2-ethylcyclopropyl)-N-methylbutan-2-amine (PubChem CID 123849930) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine.

Molecular Properties

Compound Name1-(2-ethylcyclopropyl)-N-methylbutan-2-amine
PubChem CID123849930
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-(2-ethylcyclopropyl)-N-methylbutan-2-amine
SMILESCCC(CC1CC1CC)NC
InChIInChI=1S/C10H21N/c1-4-8-6-9(8)7-10(5-2)11-3/h8-11H,4-7H2,1-3H3
InChIKeyXCIHCWOAAVAFSO-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine?
The IUPAC name of 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine (CID 123849930) is 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine.
What is the SMILES notation for 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine?
The canonical SMILES for 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine is CCC(CC1CC1CC)NC.
What is the InChIKey of 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine?
The InChIKey is XCIHCWOAAVAFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-4-8-6-9(8)7-10(5-2)11-3/h8-11H,4-7H2,1-3H3.
What are the key properties of 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine?
1-(2-ethylcyclopropyl)-N-methylbutan-2-amine has a molecular weight of 155.28 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclopropyl)-N-methylbutan-2-amine is sourced from PubChem (CID 123849930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).