2-imino-7-methoxychromene-3-carbonitrile

C11H8N2O2 — CID 11401381

IUPAC2-imino-7-methoxychromene-3-carbonitrile
SMILES[H]/N=c1\oc2cc(OC)ccc2cc1C#N
InChIInChI=1S/C11H8N2O2/c1-14-9-3-2-7-4-8(6-12)11(13)15-10(7)5-9/h2-5,13H,1H3/b13-11-
InChIKeyMUNVHTPOCHPVLK-QBFSEMIESA-N
MW200.20 g/mol
LogP1.79
Rot. Bonds1

About 2-imino-7-methoxychromene-3-carbonitrile

2-imino-7-methoxychromene-3-carbonitrile (PubChem CID 11401381) has the molecular formula C11H8N2O2 and a molecular weight of 200.20 g/mol. Its IUPAC name is 2-imino-7-methoxychromene-3-carbonitrile.

Molecular Properties

Compound Name2-imino-7-methoxychromene-3-carbonitrile
PubChem CID11401381
Molecular FormulaC11H8N2O2
Molecular Weight200.20 g/mol
Exact Mass200.06
IUPAC Name2-imino-7-methoxychromene-3-carbonitrile
SMILES[H]/N=c1\oc2cc(OC)ccc2cc1C#N
InChIInChI=1S/C11H8N2O2/c1-14-9-3-2-7-4-8(6-12)11(13)15-10(7)5-9/h2-5,13H,1H3/b13-11-
InChIKeyMUNVHTPOCHPVLK-QBFSEMIESA-N
XLogP1.79
TPSA70.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methoxy-3-(4-nitrophenyl)chromen-2-imine
CID 53356330
1-(3-hydroxy-6-methylnaphthalen-2-yl)ethanone;2-imino-8-methylbenzo[g]chromene-3-carbonitrile
CID 161041413
2-imino-7-methoxy-N-(4-methylphenyl)chromene-3-carboxamide
CID 4276831
CID 10264721
CID 10264721
2-(6-methoxy-1,3-benzoxazol-2-yl)benzonitrile
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7-methoxy-2-sulfanylidene-1H-quinoline-3-carbonitrile
CID 865244
4-methoxy-2-naphthalen-2-yloxybenzonitrile
CID 81297139
2-(1-isocyanoethyl)-6-methoxy-1-benzofuran
CID 4600633
3-(4-methoxyphenyl)-2-oxochromene-7-carbonitrile
CID 124928122
2-imino-6-methoxy-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 3245498
ethyl (NE)-N-(3-cyano-6-methoxychromen-2-ylidene)carbamate
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7-methoxy-2-oxochromene-3-carbaldehyde
CID 10420437

Frequently Asked Questions

What is the IUPAC name of 2-imino-7-methoxychromene-3-carbonitrile?
The IUPAC name of 2-imino-7-methoxychromene-3-carbonitrile (CID 11401381) is 2-imino-7-methoxychromene-3-carbonitrile.
What is the SMILES notation for 2-imino-7-methoxychromene-3-carbonitrile?
The canonical SMILES for 2-imino-7-methoxychromene-3-carbonitrile is [H]/N=c1\oc2cc(OC)ccc2cc1C#N.
What is the InChIKey of 2-imino-7-methoxychromene-3-carbonitrile?
The InChIKey is MUNVHTPOCHPVLK-QBFSEMIESA-N. The full InChI is InChI=1S/C11H8N2O2/c1-14-9-3-2-7-4-8(6-12)11(13)15-10(7)5-9/h2-5,13H,1H3/b13-11-.
What are the key properties of 2-imino-7-methoxychromene-3-carbonitrile?
2-imino-7-methoxychromene-3-carbonitrile has a molecular weight of 200.20 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imino-7-methoxychromene-3-carbonitrile is sourced from PubChem (CID 11401381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).