N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine

C19H22N2O — CID 110839835

IUPACN-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine
SMILESC(=NNCc1ccccc1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C19H22N2O/c1-2-6-16(7-3-1)14-20-21-15-17-10-12-19(13-11-17)22-18-8-4-5-9-18/h1-3,6-7,10-13,15,18,20H,4-5,8-9,14H2
InChIKeyFULJKHUROHVOSA-UHFFFAOYSA-N
MW294.40 g/mol
LogP4.13
Rot. Bonds6

About N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine

N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine (PubChem CID 110839835) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine
PubChem CID110839835
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC NameN-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine
SMILESC(=NNCc1ccccc1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C19H22N2O/c1-2-6-16(7-3-1)14-20-21-15-17-10-12-19(13-11-17)22-18-8-4-5-9-18/h1-3,6-7,10-13,15,18,20H,4-5,8-9,14H2
InChIKeyFULJKHUROHVOSA-UHFFFAOYSA-N
XLogP4.13
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(4-cyclohexyloxyphenyl)methylidene]hydrazinyl]ethanol
CID 110840083
N-[(4-cyclohexyloxyphenyl)methylideneamino]methanamine
CID 110839617
N-[(E)-(4-chlorophenyl)methylideneamino]-1-phenylmethanamine
CID 134092995
N-[(4-cyclopentyloxyphenyl)methylideneamino]-4-methylaniline
CID 110840948
benzyl N'-[(4-cyclopentyloxyphenyl)methylideneamino]carbamimidothioate
CID 168612077
N-[[4-[(3,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-1-phenylmethanamine
CID 110839719
1,2-bis[(4-cyclopentyloxyphenyl)methylideneamino]guanidine
CID 123913472
N-[(4-cyclopentyloxyphenyl)methyl]cyclopropanamine
CID 39248013
N-[(4-cyclopentyloxyphenyl)methyl]cyclopentanamine
CID 39360486
N-benzyl-4-[(benzylhydrazinylidene)methyl]-N-ethylaniline
CID 110839639
N-[(4-cyclopentyloxyphenyl)methyl]cyclohexanamine
CID 39372881
4-cyclopentyloxybenzaldehyde
CID 3152724

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine?
The IUPAC name of N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine (CID 110839835) is N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine.
What is the SMILES notation for N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine?
The canonical SMILES for N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine is C(=NNCc1ccccc1)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine?
The InChIKey is FULJKHUROHVOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c1-2-6-16(7-3-1)14-20-21-15-17-10-12-19(13-11-17)22-18-8-4-5-9-18/h1-3,6-7,10-13,15,18,20H,4-5,8-9,14H2.
What are the key properties of N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine?
N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine has a molecular weight of 294.40 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclopentyloxyphenyl)methylideneamino]-1-phenylmethanamine is sourced from PubChem (CID 110839835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).