N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine

C19H21NO — CID 23343854

IUPACN-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine
SMILESc1ccc(COc2ccc(CN=C3CCCC3)cc2)cc1
InChIInChI=1S/C19H21NO/c1-2-6-17(7-3-1)15-21-19-12-10-16(11-13-19)14-20-18-8-4-5-9-18/h1-3,6-7,10-13H,4-5,8-9,14-15H2
InChIKeyGUWJSWHBUWMXIN-UHFFFAOYSA-N
MW279.38 g/mol
LogP4.78
Rot. Bonds5

About N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine

N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine (PubChem CID 23343854) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine.

Molecular Properties

Compound NameN-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine
PubChem CID23343854
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC NameN-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine
SMILESc1ccc(COc2ccc(CN=C3CCCC3)cc2)cc1
InChIInChI=1S/C19H21NO/c1-2-6-17(7-3-1)15-21-19-12-10-16(11-13-19)14-20-18-8-4-5-9-18/h1-3,6-7,10-13H,4-5,8-9,14-15H2
InChIKeyGUWJSWHBUWMXIN-UHFFFAOYSA-N
XLogP4.78
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(benzylperoxymethyl)-4-[[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]methoxy]benzene
CID 156694250
N-(cyclohexylideneamino)-2-(4-phenylmethoxyphenoxy)acetamide
CID 29154497
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
2-[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]-1,3-dithiane
CID 19989566
ethene;1-ethoxy-4-phenylmethoxybenzene
CID 174705965
1,4-bis[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
CID 6480590
(4-phenylmethoxyphenyl) hypobromite
CID 151898979
1-phenylmethoxy-4-[9-(4-phenylmethoxyphenoxy)nonoxy]benzene
CID 43835980
4-phenylmethoxyaniline
CID 159966727
4-[cyclooctylidene-(4-phenylmethoxyphenyl)methyl]phenol
CID 69163901
1-(cyclobutylmethoxymethyl)-4-phenylmethoxybenzene
CID 125465491
N-(cyclododecylideneamino)-4-(phenoxymethyl)benzamide
CID 4225123

Frequently Asked Questions

What is the IUPAC name of N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine?
The IUPAC name of N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine (CID 23343854) is N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine.
What is the SMILES notation for N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine?
The canonical SMILES for N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine is c1ccc(COc2ccc(CN=C3CCCC3)cc2)cc1.
What is the InChIKey of N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine?
The InChIKey is GUWJSWHBUWMXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-2-6-17(7-3-1)15-21-19-12-10-16(11-13-19)14-20-18-8-4-5-9-18/h1-3,6-7,10-13H,4-5,8-9,14-15H2.
What are the key properties of N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine?
N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine has a molecular weight of 279.38 g/mol, XLogP of 4.78, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-phenylmethoxyphenyl)methyl]cyclopentanimine is sourced from PubChem (CID 23343854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).