4-cyclopentyl-1-methoxy-N-methylbutan-2-amine

C11H23NO — CID 62320367

IUPAC4-cyclopentyl-1-methoxy-N-methylbutan-2-amine
SMILESCNC(CCC1CCCC1)COC
InChIInChI=1S/C11H23NO/c1-12-11(9-13-2)8-7-10-5-3-4-6-10/h10-12H,3-9H2,1-2H3
InChIKeyNVHUNMHXMQGXDW-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.19
Rot. Bonds6

About 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine

4-cyclopentyl-1-methoxy-N-methylbutan-2-amine (PubChem CID 62320367) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-1-methoxy-N-methylbutan-2-amine
PubChem CID62320367
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name4-cyclopentyl-1-methoxy-N-methylbutan-2-amine
SMILESCNC(CCC1CCCC1)COC
InChIInChI=1S/C11H23NO/c1-12-11(9-13-2)8-7-10-5-3-4-6-10/h10-12H,3-9H2,1-2H3
InChIKeyNVHUNMHXMQGXDW-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine?
The IUPAC name of 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine (CID 62320367) is 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine.
What is the SMILES notation for 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine?
The canonical SMILES for 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine is CNC(CCC1CCCC1)COC.
What is the InChIKey of 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine?
The InChIKey is NVHUNMHXMQGXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-12-11(9-13-2)8-7-10-5-3-4-6-10/h10-12H,3-9H2,1-2H3.
What are the key properties of 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine?
4-cyclopentyl-1-methoxy-N-methylbutan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-1-methoxy-N-methylbutan-2-amine is sourced from PubChem (CID 62320367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).