N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide

C16H22N2O2 — CID 146803946

IUPACN-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide
SMILESCc1c(NC(=O)C2CCCCCC2)cnc2c1CCO2
InChIInChI=1S/C16H22N2O2/c1-11-13-8-9-20-16(13)17-10-14(11)18-15(19)12-6-4-2-3-5-7-12/h10,12H,2-9H2,1H3,(H,18,19)
InChIKeyPXCBIOKUDJQDBI-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.23
Rot. Bonds2

About N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide

N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide (PubChem CID 146803946) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide.

Molecular Properties

Compound NameN-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide
PubChem CID146803946
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide
SMILESCc1c(NC(=O)C2CCCCCC2)cnc2c1CCO2
InChIInChI=1S/C16H22N2O2/c1-11-13-8-9-20-16(13)17-10-14(11)18-15(19)12-6-4-2-3-5-7-12/h10,12H,2-9H2,1H3,(H,18,19)
InChIKeyPXCBIOKUDJQDBI-UHFFFAOYSA-N
XLogP3.23
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)cyclononanecarboxamide
CID 135213240
[3-(cyclooctanecarbonylamino)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl] acetate
CID 135213118
N-[4-(cyclodecapentaenyl)-7-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]cycloundecanecarboxamide
CID 155453112
N-(1,2,5-oxadiazol-3-yl)cyclohexanecarboxamide
CID 143329379
N-[6-(butanoylamino)-4-methyl-3-pyridinyl]cyclohexanecarboxamide
CID 1452762
N-(2-methoxy-5-methyl-3-pyridinyl)cyclopentanecarboxamide
CID 71983272
N-(2-chloro-4-hydrazinylpyrimidin-5-yl)cyclopentanecarboxamide
CID 167327368
N-(7-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)acetamide
CID 90287320
N-(5-methyl-1,3-oxazol-2-yl)cyclobutanecarboxamide
CID 131203623
N-(5-methyl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 65022914
N-(6-bromo-2-methyl-3-pyridinyl)cyclohexanecarboxamide
CID 103909516
N-(7-amino-2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptanecarboxamide
CID 62585586

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide?
The IUPAC name of N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide (CID 146803946) is N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide.
What is the SMILES notation for N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide?
The canonical SMILES for N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide is Cc1c(NC(=O)C2CCCCCC2)cnc2c1CCO2.
What is the InChIKey of N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide?
The InChIKey is PXCBIOKUDJQDBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-11-13-8-9-20-16(13)17-10-14(11)18-15(19)12-6-4-2-3-5-7-12/h10,12H,2-9H2,1H3,(H,18,19).
What are the key properties of N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide?
N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide has a molecular weight of 274.36 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide is sourced from PubChem (CID 146803946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).