6-ethyl-1-phenyldecan-4-amine

C18H31N — CID 105102887

IUPAC6-ethyl-1-phenyldecan-4-amine
SMILESCCCCC(CC)CC(N)CCCc1ccccc1
InChIInChI=1S/C18H31N/c1-3-5-10-16(4-2)15-18(19)14-9-13-17-11-7-6-8-12-17/h6-8,11-12,16,18H,3-5,9-10,13-15,19H2,1-2H3
InChIKeyJXNFCRDAMJNIHX-UHFFFAOYSA-N
MW261.45 g/mol
LogP4.94
Rot. Bonds10

About 6-ethyl-1-phenyldecan-4-amine

6-ethyl-1-phenyldecan-4-amine (PubChem CID 105102887) has the molecular formula C18H31N and a molecular weight of 261.45 g/mol. Its IUPAC name is 6-ethyl-1-phenyldecan-4-amine.

Molecular Properties

Compound Name6-ethyl-1-phenyldecan-4-amine
PubChem CID105102887
Molecular FormulaC18H31N
Molecular Weight261.45 g/mol
Exact Mass261.25
IUPAC Name6-ethyl-1-phenyldecan-4-amine
SMILESCCCCC(CC)CC(N)CCCc1ccccc1
InChIInChI=1S/C18H31N/c1-3-5-10-16(4-2)15-18(19)14-9-13-17-11-7-6-8-12-17/h6-8,11-12,16,18H,3-5,9-10,13-15,19H2,1-2H3
InChIKeyJXNFCRDAMJNIHX-UHFFFAOYSA-N
XLogP4.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.45
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 15897

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-phenyldecan-4-amine?
The IUPAC name of 6-ethyl-1-phenyldecan-4-amine (CID 105102887) is 6-ethyl-1-phenyldecan-4-amine.
What is the SMILES notation for 6-ethyl-1-phenyldecan-4-amine?
The canonical SMILES for 6-ethyl-1-phenyldecan-4-amine is CCCCC(CC)CC(N)CCCc1ccccc1.
What is the InChIKey of 6-ethyl-1-phenyldecan-4-amine?
The InChIKey is JXNFCRDAMJNIHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N/c1-3-5-10-16(4-2)15-18(19)14-9-13-17-11-7-6-8-12-17/h6-8,11-12,16,18H,3-5,9-10,13-15,19H2,1-2H3.
What are the key properties of 6-ethyl-1-phenyldecan-4-amine?
6-ethyl-1-phenyldecan-4-amine has a molecular weight of 261.45 g/mol, XLogP of 4.94, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-phenyldecan-4-amine is sourced from PubChem (CID 105102887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).