[4-[(nonylamino)methyl]phenyl]methanol

C17H29NO — CID 107230873

IUPAC[4-[(nonylamino)methyl]phenyl]methanol
SMILESCCCCCCCCCNCc1ccc(CO)cc1
InChIInChI=1S/C17H29NO/c1-2-3-4-5-6-7-8-13-18-14-16-9-11-17(15-19)12-10-16/h9-12,18-19H,2-8,13-15H2,1H3
InChIKeySEOYDFOUQKTXLC-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.02
Rot. Bonds11

About [4-[(nonylamino)methyl]phenyl]methanol

[4-[(nonylamino)methyl]phenyl]methanol (PubChem CID 107230873) has the molecular formula C17H29NO and a molecular weight of 263.43 g/mol. Its IUPAC name is [4-[(nonylamino)methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[(nonylamino)methyl]phenyl]methanol
PubChem CID107230873
Molecular FormulaC17H29NO
Molecular Weight263.43 g/mol
Exact Mass263.22
IUPAC Name[4-[(nonylamino)methyl]phenyl]methanol
SMILESCCCCCCCCCNCc1ccc(CO)cc1
InChIInChI=1S/C17H29NO/c1-2-3-4-5-6-7-8-13-18-14-16-9-11-17(15-19)12-10-16/h9-12,18-19H,2-8,13-15H2,1H3
InChIKeySEOYDFOUQKTXLC-UHFFFAOYSA-N
XLogP4.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[(nonadecylamino)methyl]phenol
CID 70039599
4-[(4-nonylphenyl)methylamino]butan-1-ol
CID 70951495
N-[(4-methylphenyl)methyl]octan-1-amine;hydrochloride
CID 17331169
N-[(4-ethylphenyl)methyl]pentan-1-amine;hydrochloride
CID 17291031
[4-[(6-methylsulfanylhexylamino)methyl]phenyl]methanol
CID 114125587
4-[(heptadecylamino)methyl]benzenesulfonic acid
CID 23547340
N-benzyltridecan-1-amine;hydrochloride
CID 173249552
2-[4-[(hexylamino)methyl]phenoxy]ethanol;hydrochloride
CID 17213255
N-[[4-(trifluoromethyl)phenyl]methyl]nonan-1-amine
CID 60669224
N-[(4-hexoxyphenyl)methyl]hexan-1-amine
CID 54807832
4-[(heptylamino)methyl]-N-methylbenzamide
CID 43114052
formaldehyde;N-[(4-heptylphenyl)methyl]butan-1-amine;methanol
CID 142267281

Frequently Asked Questions

What is the IUPAC name of [4-[(nonylamino)methyl]phenyl]methanol?
The IUPAC name of [4-[(nonylamino)methyl]phenyl]methanol (CID 107230873) is [4-[(nonylamino)methyl]phenyl]methanol.
What is the SMILES notation for [4-[(nonylamino)methyl]phenyl]methanol?
The canonical SMILES for [4-[(nonylamino)methyl]phenyl]methanol is CCCCCCCCCNCc1ccc(CO)cc1.
What is the InChIKey of [4-[(nonylamino)methyl]phenyl]methanol?
The InChIKey is SEOYDFOUQKTXLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-2-3-4-5-6-7-8-13-18-14-16-9-11-17(15-19)12-10-16/h9-12,18-19H,2-8,13-15H2,1H3.
What are the key properties of [4-[(nonylamino)methyl]phenyl]methanol?
[4-[(nonylamino)methyl]phenyl]methanol has a molecular weight of 263.43 g/mol, XLogP of 4.02, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(nonylamino)methyl]phenyl]methanol is sourced from PubChem (CID 107230873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).