1-[(N-ethylanilino)methyl]cyclopentan-1-ol

C14H21NO — CID 126846855

IUPAC1-[(N-ethylanilino)methyl]cyclopentan-1-ol
SMILESCCN(CC1(O)CCCC1)c1ccccc1
InChIInChI=1S/C14H21NO/c1-2-15(13-8-4-3-5-9-13)12-14(16)10-6-7-11-14/h3-5,8-9,16H,2,6-7,10-12H2,1H3
InChIKeyCZIOONWOWJUYLD-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.82
Rot. Bonds4

About 1-[(N-ethylanilino)methyl]cyclopentan-1-ol

1-[(N-ethylanilino)methyl]cyclopentan-1-ol (PubChem CID 126846855) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-[(N-ethylanilino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(N-ethylanilino)methyl]cyclopentan-1-ol
PubChem CID126846855
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-[(N-ethylanilino)methyl]cyclopentan-1-ol
SMILESCCN(CC1(O)CCCC1)c1ccccc1
InChIInChI=1S/C14H21NO/c1-2-15(13-8-4-3-5-9-13)12-14(16)10-6-7-11-14/h3-5,8-9,16H,2,6-7,10-12H2,1H3
InChIKeyCZIOONWOWJUYLD-UHFFFAOYSA-N
XLogP2.82
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(N-ethylanilino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(N-ethylanilino)methyl]cyclopentan-1-ol (CID 126846855) is 1-[(N-ethylanilino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(N-ethylanilino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(N-ethylanilino)methyl]cyclopentan-1-ol is CCN(CC1(O)CCCC1)c1ccccc1.
What is the InChIKey of 1-[(N-ethylanilino)methyl]cyclopentan-1-ol?
The InChIKey is CZIOONWOWJUYLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-15(13-8-4-3-5-9-13)12-14(16)10-6-7-11-14/h3-5,8-9,16H,2,6-7,10-12H2,1H3.
What are the key properties of 1-[(N-ethylanilino)methyl]cyclopentan-1-ol?
1-[(N-ethylanilino)methyl]cyclopentan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(N-ethylanilino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 126846855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).