[4-[(1-phenylpentylamino)methyl]phenyl]methanol

C19H25NO — CID 107230172

IUPAC[4-[(1-phenylpentylamino)methyl]phenyl]methanol
SMILESCCCCC(NCc1ccc(CO)cc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-2-3-9-19(18-7-5-4-6-8-18)20-14-16-10-12-17(15-21)13-11-16/h4-8,10-13,19-21H,2-3,9,14-15H2,1H3
InChIKeyKHCISBHZNBBBRU-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.20
Rot. Bonds8

About [4-[(1-phenylpentylamino)methyl]phenyl]methanol

[4-[(1-phenylpentylamino)methyl]phenyl]methanol (PubChem CID 107230172) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is [4-[(1-phenylpentylamino)methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[(1-phenylpentylamino)methyl]phenyl]methanol
PubChem CID107230172
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name[4-[(1-phenylpentylamino)methyl]phenyl]methanol
SMILESCCCCC(NCc1ccc(CO)cc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-2-3-9-19(18-7-5-4-6-8-18)20-14-16-10-12-17(15-21)13-11-16/h4-8,10-13,19-21H,2-3,9,14-15H2,1H3
InChIKeyKHCISBHZNBBBRU-UHFFFAOYSA-N
XLogP4.20
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(1-phenylhexylamino)methyl]phenol
CID 115715711
[4-[[(2-methoxy-1-phenylethyl)amino]methyl]phenyl]methanol
CID 103947386
2-[(4-butoxyphenyl)methylamino]-2-phenylethanol
CID 119134482
phenylmethanol;1-phenylpentan-1-ol
CID 160862998
N-(1-phenylpentyl)heptan-1-amine
CID 10084030
N-[(4-methoxyphenyl)methyl]-1-phenylbutan-1-amine;hydrochloride
CID 17156102
(3R)-3-[(4-methylsulfanylphenyl)methylamino]-3-phenylpropan-1-ol
CID 111449945
4-[[(4-hydroxy-1-phenylbutyl)amino]methyl]benzamide
CID 111449752
(1S)-N-methyl-1-phenylpentan-1-amine
CID 86314170
N-(2,2-dimethylpropyl)-1-phenylpentan-1-amine
CID 55191412
1-phenyl-N-(pyridin-4-ylmethyl)butan-1-amine;hydrochloride
CID 17155648
[(1S)-1-phenylpentyl]hydrazine
CID 124537681

Frequently Asked Questions

What is the IUPAC name of [4-[(1-phenylpentylamino)methyl]phenyl]methanol?
The IUPAC name of [4-[(1-phenylpentylamino)methyl]phenyl]methanol (CID 107230172) is [4-[(1-phenylpentylamino)methyl]phenyl]methanol.
What is the SMILES notation for [4-[(1-phenylpentylamino)methyl]phenyl]methanol?
The canonical SMILES for [4-[(1-phenylpentylamino)methyl]phenyl]methanol is CCCCC(NCc1ccc(CO)cc1)c1ccccc1.
What is the InChIKey of [4-[(1-phenylpentylamino)methyl]phenyl]methanol?
The InChIKey is KHCISBHZNBBBRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-2-3-9-19(18-7-5-4-6-8-18)20-14-16-10-12-17(15-21)13-11-16/h4-8,10-13,19-21H,2-3,9,14-15H2,1H3.
What are the key properties of [4-[(1-phenylpentylamino)methyl]phenyl]methanol?
[4-[(1-phenylpentylamino)methyl]phenyl]methanol has a molecular weight of 283.42 g/mol, XLogP of 4.20, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(1-phenylpentylamino)methyl]phenyl]methanol is sourced from PubChem (CID 107230172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).