N-cyclohexyl-2H-chromene-3-carboxamide

C16H19NO2 — CID 9043314

IUPACN-cyclohexyl-2H-chromene-3-carboxamide
SMILESO=C(NC1CCCCC1)C1=Cc2ccccc2OC1
InChIInChI=1S/C16H19NO2/c18-16(17-14-7-2-1-3-8-14)13-10-12-6-4-5-9-15(12)19-11-13/h4-6,9-10,14H,1-3,7-8,11H2,(H,17,18)
InChIKeyVRRCZXDDONXGJU-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.91
Rot. Bonds2

About N-cyclohexyl-2H-chromene-3-carboxamide

N-cyclohexyl-2H-chromene-3-carboxamide (PubChem CID 9043314) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-cyclohexyl-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2H-chromene-3-carboxamide
PubChem CID9043314
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-cyclohexyl-2H-chromene-3-carboxamide
SMILESO=C(NC1CCCCC1)C1=Cc2ccccc2OC1
InChIInChI=1S/C16H19NO2/c18-16(17-14-7-2-1-3-8-14)13-10-12-6-4-5-9-15(12)19-11-13/h4-6,9-10,14H,1-3,7-8,11H2,(H,17,18)
InChIKeyVRRCZXDDONXGJU-UHFFFAOYSA-N
XLogP2.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 22578430
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[2-(cyclohexylamino)-2-oxo-1-phenylethyl] 2H-chromene-3-carboxylate
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N-methyl-2H-chromene-3-carboxamide
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[(2S)-1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
CID 8745772
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[(1R)-2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl] 2H-chromene-3-carboxylate
CID 1444651
N-cyclohexyl-1-benzoxepine-4-carboxamide
CID 16648766
N-(4-acetamidophenyl)-2H-chromene-3-carboxamide
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N-(2-fluorophenyl)-2H-chromene-3-carboxamide
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N-(4-acetylphenyl)-2H-chromene-3-carboxamide
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[4-(2H-chromene-3-carbonyl)piperazin-1-yl]-cyclopentylmethanone
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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2H-chromene-3-carboxamide?
The IUPAC name of N-cyclohexyl-2H-chromene-3-carboxamide (CID 9043314) is N-cyclohexyl-2H-chromene-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-2H-chromene-3-carboxamide?
The canonical SMILES for N-cyclohexyl-2H-chromene-3-carboxamide is O=C(NC1CCCCC1)C1=Cc2ccccc2OC1.
What is the InChIKey of N-cyclohexyl-2H-chromene-3-carboxamide?
The InChIKey is VRRCZXDDONXGJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c18-16(17-14-7-2-1-3-8-14)13-10-12-6-4-5-9-15(12)19-11-13/h4-6,9-10,14H,1-3,7-8,11H2,(H,17,18).
What are the key properties of N-cyclohexyl-2H-chromene-3-carboxamide?
N-cyclohexyl-2H-chromene-3-carboxamide has a molecular weight of 257.33 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2H-chromene-3-carboxamide is sourced from PubChem (CID 9043314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).