N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide

C20H28N2O — CID 110440172

IUPACN-[5-(diethylamino)pentyl]naphthalene-1-carboxamide
SMILESCCN(CC)CCCCCNC(=O)c1cccc2ccccc12
InChIInChI=1S/C20H28N2O/c1-3-22(4-2)16-9-5-8-15-21-20(23)19-14-10-12-17-11-6-7-13-18(17)19/h6-7,10-14H,3-5,8-9,15-16H2,1-2H3,(H,21,23)
InChIKeyBXMIYNYCEGLOLY-UHFFFAOYSA-N
MW312.46 g/mol
LogP4.08
Rot. Bonds9

About N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide

N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide (PubChem CID 110440172) has the molecular formula C20H28N2O and a molecular weight of 312.46 g/mol. Its IUPAC name is N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[5-(diethylamino)pentyl]naphthalene-1-carboxamide
PubChem CID110440172
Molecular FormulaC20H28N2O
Molecular Weight312.46 g/mol
Exact Mass312.22
IUPAC NameN-[5-(diethylamino)pentyl]naphthalene-1-carboxamide
SMILESCCN(CC)CCCCCNC(=O)c1cccc2ccccc12
InChIInChI=1S/C20H28N2O/c1-3-22(4-2)16-9-5-8-15-21-20(23)19-14-10-12-17-11-6-7-13-18(17)19/h6-7,10-14H,3-5,8-9,15-16H2,1-2H3,(H,21,23)
InChIKeyBXMIYNYCEGLOLY-UHFFFAOYSA-N
XLogP4.08
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.46
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[11-(naphthalene-1-carbonylamino)undecyl]naphthalene-1-carboxamide
CID 137492009
N-dodecylnaphthalene-1-carboxamide
CID 4278758
N-(6-iodohexyl)naphthalene-1-carboxamide
CID 107848597
6-(naphthalene-1-carbonylamino)hexanoic acid
CID 14196780
N-(3-chloropropyl)naphthalene-1-carboxamide
CID 17164120
ethane;N-ethylnaphthalene-1-carboxamide;propane
CID 144944456
N-hex-5-ynylnaphthalene-1-carboxamide
CID 103757850
N-[3-(diethylamino)propyl]-2-iodo-3-methylbenzamide
CID 113222868
N-[3-(diethylamino)propyl]-2-(propylamino)benzamide
CID 62165335
1-N,2-N-bis[2-[di(nonyl)amino]ethyl]benzene-1,2-dicarboxamide
CID 139956764
N-[3-(diethylamino)propyl]-2-[2-(methylamino)ethyl]benzamide
CID 104547307
N-[3-(diethylamino)propyl]-2-nitrobenzamide
CID 3286089

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide?
The IUPAC name of N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide (CID 110440172) is N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide is CCN(CC)CCCCCNC(=O)c1cccc2ccccc12.
What is the InChIKey of N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide?
The InChIKey is BXMIYNYCEGLOLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O/c1-3-22(4-2)16-9-5-8-15-21-20(23)19-14-10-12-17-11-6-7-13-18(17)19/h6-7,10-14H,3-5,8-9,15-16H2,1-2H3,(H,21,23).
What are the key properties of N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide?
N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide has a molecular weight of 312.46 g/mol, XLogP of 4.08, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylamino)pentyl]naphthalene-1-carboxamide is sourced from PubChem (CID 110440172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).