ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide

C17H26N2O2 — CID 142886721

IUPACethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide
SMILESC/C=C(\C=C/C(C)C)Oc1ccnc(C(=O)NC)c1.CC
InChIInChI=1S/C15H20N2O2.C2H6/c1-5-12(7-6-11(2)3)19-13-8-9-17-14(10-13)15(18)16-4;1-2/h5-11H,1-4H3,(H,16,18);1-2H3/b7-6-,12-5+;
InChIKeyCWNTXMRAOLQLBR-QIPXERRSSA-N
MW290.41 g/mol
LogP3.96
Rot. Bonds5

About ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide

ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide (PubChem CID 142886721) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Nameethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide
PubChem CID142886721
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Nameethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide
SMILESC/C=C(\C=C/C(C)C)Oc1ccnc(C(=O)NC)c1.CC
InChIInChI=1S/C15H20N2O2.C2H6/c1-5-12(7-6-11(2)3)19-13-8-9-17-14(10-13)15(18)16-4;1-2/h5-11H,1-4H3,(H,16,18);1-2H3/b7-6-,12-5+;
InChIKeyCWNTXMRAOLQLBR-QIPXERRSSA-N
XLogP3.96
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

N-methyl-4-[(2E,5Z)-7-methylocta-2,5-dien-3-yl]oxypyridine-2-carboxamide
CID 142886716
4-[4-(hexa-2,4-dien-3-ylsulfonylamino)phenoxy]-N-methylpyridine-2-carboxamide
CID 123302198
3-methyl-4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]benzoic acid
CID 107672806
4-(4-amino-3-methylphenoxy)-N-methylpyridine-2-carboxamide;hydrochloride
CID 66746840
N-methyl-4-[2-[[2-methyl-3-(methylamino)propanoyl]amino]phenoxy]pyridine-2-carboxamide
CID 119893191
N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen
CID 164540019
4-[3-[[(4-methoxybenzoyl)amino]carbamoyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 58858348
4-(2-aminoquinolin-6-yl)oxy-N-methylpyridine-2-carboxamide
CID 71019360
N-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]carbamate
CID 86648443
2-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]acetic acid
CID 61395400
4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide
CID 142886612
N-methyl-4-[4-[(4-methylphenyl)carbamothioylamino]phenoxy]pyridine-2-carboxamide
CID 141473965

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide?
The IUPAC name of ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide (CID 142886721) is ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide?
The canonical SMILES for ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide is C/C=C(\C=C/C(C)C)Oc1ccnc(C(=O)NC)c1.CC.
What is the InChIKey of ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide?
The InChIKey is CWNTXMRAOLQLBR-QIPXERRSSA-N. The full InChI is InChI=1S/C15H20N2O2.C2H6/c1-5-12(7-6-11(2)3)19-13-8-9-17-14(10-13)15(18)16-4;1-2/h5-11H,1-4H3,(H,16,18);1-2H3/b7-6-,12-5+;.
What are the key properties of ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide?
ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-4-[(2E,4Z)-6-methylhepta-2,4-dien-3-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 142886721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).