N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide

C14H12ClNO2 — CID 135035742

IUPACN-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide
SMILESO=CN(Cc1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C14H12ClNO2/c15-12-7-5-11(6-8-12)9-16(10-17)13-3-1-2-4-14(13)18/h1-8,10,18H,9H2
InChIKeyANWSTLDGFOLPAL-UHFFFAOYSA-N
MW261.71 g/mol
LogP3.21
Rot. Bonds4

About N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide

N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide (PubChem CID 135035742) has the molecular formula C14H12ClNO2 and a molecular weight of 261.71 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide
PubChem CID135035742
Molecular FormulaC14H12ClNO2
Molecular Weight261.71 g/mol
Exact Mass261.06
IUPAC NameN-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide
SMILESO=CN(Cc1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C14H12ClNO2/c15-12-7-5-11(6-8-12)9-16(10-17)13-3-1-2-4-14(13)18/h1-8,10,18H,9H2
InChIKeyANWSTLDGFOLPAL-UHFFFAOYSA-N
XLogP3.21
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.71
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(4-chlorophenyl)methyl-methylamino]benzaldehyde
CID 61415174
2-[benzyl-[(E)-prop-1-enyl]amino]phenol
CID 141322708
N-ethoxy-N-(2-hydroxyphenyl)formamide
CID 174744666
N-ethyl-N-[2-hydroxy-5-(2-phenylethyl)phenyl]formamide
CID 57048963
N-benzyl-N-[(4-chlorophenyl)methyl]-2-phenylethanamine
CID 4651725
2-[(4-chlorophenyl)methyl-methylamino]-1-phenylbutan-1-one
CID 62037391
N-[(4-chlorophenyl)methyl]-N-methyl-2-(propylaminomethyl)aniline
CID 63552832
N-(2-chloro-3-pyridinyl)-N-(2-hydroxyphenyl)formamide
CID 174438856
2-(chloromethyl)-N-[(4-chlorophenyl)methyl]-N-methylaniline
CID 63540989
2-[2-(4-chlorophenyl)ethyl-[(4-hydroxyphenyl)methyl]amino]benzamide
CID 70187700
4-[[[2-[[4-(dimethylamino)phenyl]methyl-formylamino]benzoyl]-methylamino]methyl]benzoic acid
CID 130372742
N,N'-bis[(4-chlorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
CID 10472232

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide (CID 135035742) is N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide is O=CN(Cc1ccc(Cl)cc1)c1ccccc1O.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide?
The InChIKey is ANWSTLDGFOLPAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO2/c15-12-7-5-11(6-8-12)9-16(10-17)13-3-1-2-4-14(13)18/h1-8,10,18H,9H2.
What are the key properties of N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide?
N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide has a molecular weight of 261.71 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-N-(2-hydroxyphenyl)formamide is sourced from PubChem (CID 135035742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).