N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide

C19H18N2O4 — CID 70696536

IUPACN-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide
SMILES[H]/N=c1\oc2c(OC)cccc2cc1C(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C19H18N2O4/c1-24-16-4-2-3-13-11-15(18(20)25-17(13)16)19(23)21-10-9-12-5-7-14(22)8-6-12/h2-8,11,20,22H,9-10H2,1H3,(H,21,23)/b20-18-
InChIKeyFZDOJZCUDKGLGL-ZZEZOPTASA-N
MW338.36 g/mol
LogP2.60
Rot. Bonds5

About N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide

N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide (PubChem CID 70696536) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide
PubChem CID70696536
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide
SMILES[H]/N=c1\oc2c(OC)cccc2cc1C(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C19H18N2O4/c1-24-16-4-2-3-13-11-15(18(20)25-17(13)16)19(23)21-10-9-12-5-7-14(22)8-6-12/h2-8,11,20,22H,9-10H2,1H3,(H,21,23)/b20-18-
InChIKeyFZDOJZCUDKGLGL-ZZEZOPTASA-N
XLogP2.60
TPSA95.55 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide
CID 17379757
N-(1,3-benzodioxol-5-ylmethyl)-2-imino-8-methoxychromene-3-carboxamide
CID 19289020
N-[2-(4-fluorophenyl)ethyl]-8-methoxy-2-oxochromene-3-carboxamide
CID 26795926
8-hydroxy-N-[4-[(8-hydroxy-2-iminochromene-3-carbonyl)amino]butyl]-2-iminochromene-3-carboxamide
CID 46237292
1-(2-imino-8-methoxychromen-3-yl)-2,2-dimethylpropan-1-one
CID 19288933
7-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-2-oxochromene-3-carboxamide
CID 118708727
8-ethoxy-2-imino-N-(2-methoxyphenyl)chromene-3-carboxamide
CID 19573961
N-[2-(4-hydroxyphenyl)ethyl]-2-[4-(8-methoxy-2-oxochromen-3-yl)phenoxy]acetamide
CID 42507195
8-ethoxy-2-imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 19573973
8-hydroxy-2-imino-N-(3-methoxyphenyl)chromene-3-carboxamide
CID 19573969
7-hydroxy-2-imino-N-(2-methoxyphenyl)chromene-3-carboxamide
CID 135531975
methyl 2-[(2-imino-8-methoxychromene-3-carbonyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
CID 19572171

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide (CID 70696536) is N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide is [H]/N=c1\oc2c(OC)cccc2cc1C(=O)NCCc1ccc(O)cc1.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide?
The InChIKey is FZDOJZCUDKGLGL-ZZEZOPTASA-N. The full InChI is InChI=1S/C19H18N2O4/c1-24-16-4-2-3-13-11-15(18(20)25-17(13)16)19(23)21-10-9-12-5-7-14(22)8-6-12/h2-8,11,20,22H,9-10H2,1H3,(H,21,23)/b20-18-.
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide?
N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide has a molecular weight of 338.36 g/mol, XLogP of 2.60, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxyphenyl)ethyl]-2-imino-8-methoxychromene-3-carboxamide is sourced from PubChem (CID 70696536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).