1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine

C18H33N — CID 167238174

IUPAC1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine
SMILESC=C(NC(CCC)CCC1CCCC1)C1CCCC1
InChIInChI=1S/C18H33N/c1-3-8-18(14-13-16-9-4-5-10-16)19-15(2)17-11-6-7-12-17/h16-19H,2-14H2,1H3
InChIKeyWXKRXXRMBXYKQR-UHFFFAOYSA-N
MW263.47 g/mol
LogP5.42
Rot. Bonds8

About 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine

1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine (PubChem CID 167238174) has the molecular formula C18H33N and a molecular weight of 263.47 g/mol. Its IUPAC name is 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine
PubChem CID167238174
Molecular FormulaC18H33N
Molecular Weight263.47 g/mol
Exact Mass263.26
IUPAC Name1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine
SMILESC=C(NC(CCC)CCC1CCCC1)C1CCCC1
InChIInChI=1S/C18H33N/c1-3-8-18(14-13-16-9-4-5-10-16)19-15(2)17-11-6-7-12-17/h16-19H,2-14H2,1H3
InChIKeyWXKRXXRMBXYKQR-UHFFFAOYSA-N
XLogP5.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.47
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine?
The IUPAC name of 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine (CID 167238174) is 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine.
What is the SMILES notation for 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine?
The canonical SMILES for 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine is C=C(NC(CCC)CCC1CCCC1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine?
The InChIKey is WXKRXXRMBXYKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N/c1-3-8-18(14-13-16-9-4-5-10-16)19-15(2)17-11-6-7-12-17/h16-19H,2-14H2,1H3.
What are the key properties of 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine?
1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine has a molecular weight of 263.47 g/mol, XLogP of 5.42, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(1-cyclopentylethenyl)hexan-3-amine is sourced from PubChem (CID 167238174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).