1-[(N-methylanilino)methyl]cyclohexan-1-ol

C14H21NO — CID 15311983

IUPAC1-[(N-methylanilino)methyl]cyclohexan-1-ol
SMILESCN(CC1(O)CCCCC1)c1ccccc1
InChIInChI=1S/C14H21NO/c1-15(13-8-4-2-5-9-13)12-14(16)10-6-3-7-11-14/h2,4-5,8-9,16H,3,6-7,10-12H2,1H3
InChIKeyGOFNWXOFGVYZFE-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.82
Rot. Bonds3

About 1-[(N-methylanilino)methyl]cyclohexan-1-ol

1-[(N-methylanilino)methyl]cyclohexan-1-ol (PubChem CID 15311983) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-[(N-methylanilino)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(N-methylanilino)methyl]cyclohexan-1-ol
PubChem CID15311983
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-[(N-methylanilino)methyl]cyclohexan-1-ol
SMILESCN(CC1(O)CCCCC1)c1ccccc1
InChIInChI=1S/C14H21NO/c1-15(13-8-4-2-5-9-13)12-14(16)10-6-3-7-11-14/h2,4-5,8-9,16H,3,6-7,10-12H2,1H3
InChIKeyGOFNWXOFGVYZFE-UHFFFAOYSA-N
XLogP2.82
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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-methylanilino)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(N-methylanilino)methyl]cyclohexan-1-ol (CID 15311983) is 1-[(N-methylanilino)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(N-methylanilino)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(N-methylanilino)methyl]cyclohexan-1-ol is CN(CC1(O)CCCCC1)c1ccccc1.
What is the InChIKey of 1-[(N-methylanilino)methyl]cyclohexan-1-ol?
The InChIKey is GOFNWXOFGVYZFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-15(13-8-4-2-5-9-13)12-14(16)10-6-3-7-11-14/h2,4-5,8-9,16H,3,6-7,10-12H2,1H3.
What are the key properties of 1-[(N-methylanilino)methyl]cyclohexan-1-ol?
1-[(N-methylanilino)methyl]cyclohexan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(N-methylanilino)methyl]cyclohexan-1-ol is sourced from PubChem (CID 15311983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).