(NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine

C17H14ClNO3 — CID 7730715

IUPAC(NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine
SMILESCOc1ccc(-c2c/c(=N/O)c3cc(Cl)c(C)cc3o2)cc1
InChIInChI=1S/C17H14ClNO3/c1-10-7-17-13(8-14(10)18)15(19-20)9-16(22-17)11-3-5-12(21-2)6-4-11/h3-9,20H,1-2H3/b19-15-
InChIKeyUQTJMXHTXDMNLL-CYVLTUHYSA-N
MW315.76 g/mol
LogP4.36
Rot. Bonds2

About (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine

(NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine (PubChem CID 7730715) has the molecular formula C17H14ClNO3 and a molecular weight of 315.76 g/mol. Its IUPAC name is (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine
PubChem CID7730715
Molecular FormulaC17H14ClNO3
Molecular Weight315.76 g/mol
Exact Mass315.07
IUPAC Name(NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine
SMILESCOc1ccc(-c2c/c(=N/O)c3cc(Cl)c(C)cc3o2)cc1
InChIInChI=1S/C17H14ClNO3/c1-10-7-17-13(8-14(10)18)15(19-20)9-16(22-17)11-3-5-12(21-2)6-4-11/h3-9,20H,1-2H3/b19-15-
InChIKeyUQTJMXHTXDMNLL-CYVLTUHYSA-N
XLogP4.36
TPSA54.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-[2-(4-methoxyphenyl)-6,7-dimethylchromen-4-ylidene]amino]aniline
CID 7730775
6-chloro-2-[4-(4-chlorophenoxy)phenyl]-7-methylchromen-4-one
CID 73352575
6-chloro-4-(4-chlorophenyl)-3-(4-methoxyphenyl)-7-methylchromen-2-one
CID 3563283
3-chloro-5-(4-methoxyphenyl)-2-methylfuran
CID 14592116
(NZ)-N-[6-chloro-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]hydroxylamine
CID 7730706
N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine
CID 20998835
2-chloro-8-methoxy-3-methylbenzo[c]chromen-6-one
CID 167583154
[6-chloro-2-(4-methoxyphenyl)-7-methyl-4-oxochromen-3-yl] benzoate
CID 21001587
(NZ)-N-[7-methoxy-2-[4-(4-morpholin-4-ylbutoxy)phenyl]chromen-4-ylidene]hydroxylamine
CID 87613756
2-[[6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]amino]-3-methylbutanoic acid
CID 23736058
6-hydroxy-3-(4-methoxyphenyl)-2,7-dimethylchromen-4-one
CID 13443565
2-(4-methoxyphenyl)-N-pyrrol-1-ylchromen-4-imine
CID 2325646

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine (CID 7730715) is (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine is COc1ccc(-c2c/c(=N/O)c3cc(Cl)c(C)cc3o2)cc1.
What is the InChIKey of (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine?
The InChIKey is UQTJMXHTXDMNLL-CYVLTUHYSA-N. The full InChI is InChI=1S/C17H14ClNO3/c1-10-7-17-13(8-14(10)18)15(19-20)9-16(22-17)11-3-5-12(21-2)6-4-11/h3-9,20H,1-2H3/b19-15-.
What are the key properties of (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine?
(NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine has a molecular weight of 315.76 g/mol, XLogP of 4.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine is sourced from PubChem (CID 7730715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).