1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol

C18H21NO — CID 115621532

IUPAC1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol
SMILESOC1(CNCc2ccc(-c3ccccc3)cc2)CCC1
InChIInChI=1S/C18H21NO/c20-18(11-4-12-18)14-19-13-15-7-9-17(10-8-15)16-5-2-1-3-6-16/h1-3,5-10,19-20H,4,11-14H2
InChIKeyGONZJOMQOCDENC-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.36
Rot. Bonds5

About 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol

1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol (PubChem CID 115621532) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol.

Molecular Properties

Compound Name1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol
PubChem CID115621532
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol
SMILESOC1(CNCc2ccc(-c3ccccc3)cc2)CCC1
InChIInChI=1S/C18H21NO/c20-18(11-4-12-18)14-19-13-15-7-9-17(10-8-15)16-5-2-1-3-6-16/h1-3,5-10,19-20H,4,11-14H2
InChIKeyGONZJOMQOCDENC-UHFFFAOYSA-N
XLogP3.36
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(benzylamino)methyl]cycloheptan-1-ol
CID 60710694
1-[[(4-aminophenyl)methylamino]methyl]cyclohexan-1-ol
CID 126846834
1-[[(4-fluorophenyl)methylamino]methyl]cyclohexan-1-ol
CID 17442249
N-[(1-methoxycyclobutyl)methyl]-1-(4-phenylphenyl)methanamine
CID 103991761
1-[[[4-(cyclohexen-1-yl)phenyl]methylamino]methyl]cyclohexan-1-ol
CID 70303827
1-[[(4-methylsulfanylphenyl)methylamino]methyl]cyclobutan-1-ol
CID 111114566
1-[[(4-methoxyphenyl)methylamino]methyl]cyclopentan-1-ol
CID 63931646
1-[[(4-trimethylsilylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103437869
1-[(thiophen-3-ylmethylamino)methyl]cyclopentan-1-ol
CID 63932881
1-[[(4-pyrrolidin-1-ylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 62866735
4-[[(1-hydroxycyclobutyl)methylamino]methyl]-N-methylbenzamide
CID 111114516
1-[(benzylamino)methyl]-4-ethylcyclohexan-1-ol
CID 62772640

Frequently Asked Questions

What is the IUPAC name of 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol?
The IUPAC name of 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol (CID 115621532) is 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol.
What is the SMILES notation for 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol?
The canonical SMILES for 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol is OC1(CNCc2ccc(-c3ccccc3)cc2)CCC1.
What is the InChIKey of 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol?
The InChIKey is GONZJOMQOCDENC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c20-18(11-4-12-18)14-19-13-15-7-9-17(10-8-15)16-5-2-1-3-6-16/h1-3,5-10,19-20H,4,11-14H2.
What are the key properties of 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol?
1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol has a molecular weight of 267.37 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(4-phenylphenyl)methylamino]methyl]cyclobutan-1-ol is sourced from PubChem (CID 115621532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).