2-[(1E)-cyclodecen-1-yl]-1H-pyrrole

C14H21N — CID 173176986

IUPAC2-[(1E)-cyclodecen-1-yl]-1H-pyrrole
SMILESC1=C(/c2ccc[nH]2)CCCCCCCC/1
InChIInChI=1S/C14H21N/c1-2-4-6-9-13(10-7-5-3-1)14-11-8-12-15-14/h8-9,11-12,15H,1-7,10H2/b13-9+
InChIKeyWOWNZMVOAMDQQQ-UKTHLTGXSA-N
MW203.33 g/mol
LogP4.53
Rot. Bonds1

About 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole

2-[(1E)-cyclodecen-1-yl]-1H-pyrrole (PubChem CID 173176986) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole.

Molecular Properties

Compound Name2-[(1E)-cyclodecen-1-yl]-1H-pyrrole
PubChem CID173176986
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-[(1E)-cyclodecen-1-yl]-1H-pyrrole
SMILESC1=C(/c2ccc[nH]2)CCCCCCCC/1
InChIInChI=1S/C14H21N/c1-2-4-6-9-13(10-7-5-3-1)14-11-8-12-15-14/h8-9,11-12,15H,1-7,10H2/b13-9+
InChIKeyWOWNZMVOAMDQQQ-UKTHLTGXSA-N
XLogP4.53
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole?
The IUPAC name of 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole (CID 173176986) is 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole.
What is the SMILES notation for 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole?
The canonical SMILES for 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole is C1=C(/c2ccc[nH]2)CCCCCCCC/1.
What is the InChIKey of 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole?
The InChIKey is WOWNZMVOAMDQQQ-UKTHLTGXSA-N. The full InChI is InChI=1S/C14H21N/c1-2-4-6-9-13(10-7-5-3-1)14-11-8-12-15-14/h8-9,11-12,15H,1-7,10H2/b13-9+.
What are the key properties of 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole?
2-[(1E)-cyclodecen-1-yl]-1H-pyrrole has a molecular weight of 203.33 g/mol, XLogP of 4.53, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1E)-cyclodecen-1-yl]-1H-pyrrole is sourced from PubChem (CID 173176986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).