6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide

C17H22N2O3 — CID 120574761

IUPAC6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)C=C(C(=O)NC1CCCNC1C)CO2
InChIInChI=1S/C17H22N2O3/c1-11-15(4-3-7-18-11)19-17(20)13-8-12-9-14(21-2)5-6-16(12)22-10-13/h5-6,8-9,11,15,18H,3-4,7,10H2,1-2H3,(H,19,20)
InChIKeyOFGZCEAEBNXXRL-UHFFFAOYSA-N
MW302.37 g/mol
LogP1.73
Rot. Bonds3

About 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide

6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide (PubChem CID 120574761) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide
PubChem CID120574761
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)C=C(C(=O)NC1CCCNC1C)CO2
InChIInChI=1S/C17H22N2O3/c1-11-15(4-3-7-18-11)19-17(20)13-8-12-9-14(21-2)5-6-16(12)22-10-13/h5-6,8-9,11,15,18H,3-4,7,10H2,1-2H3,(H,19,20)
InChIKeyOFGZCEAEBNXXRL-UHFFFAOYSA-N
XLogP1.73
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-6-methoxy-2H-chromene-3-carboxamide
CID 119602105
N-(8-azabicyclo[3.2.1]octan-3-yl)-6-methoxy-2H-chromene-3-carboxamide
CID 119456581
6-methoxy-N-(piperidin-3-ylmethyl)-2H-chromene-3-carboxamide;hydrochloride
CID 119461393
N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-6-methoxy-2H-chromene-3-carboxamide
CID 166186910
5-methoxy-3-methyl-N-(2-methylpiperidin-3-yl)-1-benzothiophene-2-carboxamide
CID 120574129
N-(2-methylpiperidin-3-yl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
CID 120574862
N-[(4-hydroxypyrrolidin-3-yl)methyl]-6-methoxy-2H-chromene-3-carboxamide
CID 120947707
N-(2-methylpiperidin-3-yl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide;hydrochloride
CID 120574861
N-(2,6-dimethylphenyl)-6-methoxy-2H-chromene-3-carboxamide
CID 22578350
7-methoxy-2-methyl-N-(2-methylpiperidin-3-yl)quinoline-3-carboxamide;hydrochloride
CID 120573600
2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120576347
N-[(3-fluorophenyl)methyl]-6-methoxy-2H-chromene-3-carboxamide
CID 22578403

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide?
The IUPAC name of 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide (CID 120574761) is 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide?
The canonical SMILES for 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide is COc1ccc2c(c1)C=C(C(=O)NC1CCCNC1C)CO2.
What is the InChIKey of 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide?
The InChIKey is OFGZCEAEBNXXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3/c1-11-15(4-3-7-18-11)19-17(20)13-8-12-9-14(21-2)5-6-16(12)22-10-13/h5-6,8-9,11,15,18H,3-4,7,10H2,1-2H3,(H,19,20).
What are the key properties of 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide?
6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide has a molecular weight of 302.37 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(2-methylpiperidin-3-yl)-2H-chromene-3-carboxamide is sourced from PubChem (CID 120574761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).