6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide

C15H24N2O2 — CID 143382826

IUPAC6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide
SMILESC=C1C=C(CN)OC(C(=O)NCCC(C)CC)=C1C
InChIInChI=1S/C15H24N2O2/c1-5-10(2)6-7-17-15(18)14-12(4)11(3)8-13(9-16)19-14/h8,10H,3,5-7,9,16H2,1-2,4H3,(H,17,18)
InChIKeyRWOUEFKEPVRFFB-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.24
Rot. Bonds6

About 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide

6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide (PubChem CID 143382826) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide.

Molecular Properties

Compound Name6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide
PubChem CID143382826
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide
SMILESC=C1C=C(CN)OC(C(=O)NCCC(C)CC)=C1C
InChIInChI=1S/C15H24N2O2/c1-5-10(2)6-7-17-15(18)14-12(4)11(3)8-13(9-16)19-14/h8,10H,3,5-7,9,16H2,1-2,4H3,(H,17,18)
InChIKeyRWOUEFKEPVRFFB-UHFFFAOYSA-N
XLogP2.24
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide?
The IUPAC name of 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide (CID 143382826) is 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide.
What is the SMILES notation for 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide?
The canonical SMILES for 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide is C=C1C=C(CN)OC(C(=O)NCCC(C)CC)=C1C.
What is the InChIKey of 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide?
The InChIKey is RWOUEFKEPVRFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-10(2)6-7-17-15(18)14-12(4)11(3)8-13(9-16)19-14/h8,10H,3,5-7,9,16H2,1-2,4H3,(H,17,18).
What are the key properties of 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide?
6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-3-methyl-4-methylidene-N-(3-methylpentyl)pyran-2-carboxamide is sourced from PubChem (CID 143382826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).