4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane

C18H24N2O2 — CID 144887196

IUPAC4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane
SMILESCC.CCc1cccc2c(N(C)C)ccc(C(=O)NC=O)c12
InChIInChI=1S/C16H18N2O2.C2H6/c1-4-11-6-5-7-12-14(18(2)3)9-8-13(15(11)12)16(20)17-10-19;1-2/h5-10H,4H2,1-3H3,(H,17,19,20);1-2H3
InChIKeyJSYBPQUQMHIMDV-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.38
Rot. Bonds4

About 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane

4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane (PubChem CID 144887196) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane.

Molecular Properties

Compound Name4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane
PubChem CID144887196
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane
SMILESCC.CCc1cccc2c(N(C)C)ccc(C(=O)NC=O)c12
InChIInChI=1S/C16H18N2O2.C2H6/c1-4-11-6-5-7-12-14(18(2)3)9-8-13(15(11)12)16(20)17-10-19;1-2/h5-10H,4H2,1-3H3,(H,17,19,20);1-2H3
InChIKeyJSYBPQUQMHIMDV-UHFFFAOYSA-N
XLogP3.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

4-(dimethylamino)naphthalene-1-carbohydrazide
CID 58897573
1-[4,5-bis(dimethylamino)naphthalen-1-yl]-2,2,2-trifluoroethanone
CID 2327126
4-(dimethylamino)naphthalene-1-carboxylate
CID 7005026
3-[2-[5-(dimethylamino)naphthalen-1-yl]ethylamino]propan-1-ol
CID 123228240
N,N-dimethylnaphthalen-1-amine;hydroxylamine
CID 135773162
N,N-dimethylnaphthalen-1-amine;sulfuric acid
CID 159908177
2-[3-(dimethylamino)-2-methylphenyl]acetic acid
CID 155670062
1-[8-acetyl-4-[fluoro(methyl)amino]naphthalen-1-yl]ethanone
CID 155402481
methyl 5-[[4-(dimethylamino)naphthalene-1-carbonyl]amino]hexanoate
CID 57495429
6-(dimethylamino)-2-ethyl-3-methylidenebenzo[de]isoquinolin-1-one
CID 165000358
acetic acid;1,3-diethyl-2-iodobenzene
CID 175748733
4-[(E)-[(E)-[4,5-bis(dimethylamino)naphthalen-1-yl]methylidenehydrazinylidene]methyl]-1-N,1-N,8-N,8-N-tetramethylnaphthalene-1,8-diamine
CID 14437588

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane?
The IUPAC name of 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane (CID 144887196) is 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane.
What is the SMILES notation for 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane?
The canonical SMILES for 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane is CC.CCc1cccc2c(N(C)C)ccc(C(=O)NC=O)c12.
What is the InChIKey of 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane?
The InChIKey is JSYBPQUQMHIMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2.C2H6/c1-4-11-6-5-7-12-14(18(2)3)9-8-13(15(11)12)16(20)17-10-19;1-2/h5-10H,4H2,1-3H3,(H,17,19,20);1-2H3.
What are the key properties of 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane?
4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane has a molecular weight of 300.40 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-8-ethyl-N-formylnaphthalene-1-carboxamide;ethane is sourced from PubChem (CID 144887196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).