N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide

C19H26N2O — CID 17461104

IUPACN-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide
SMILESCC(C)N(CCNC(=O)c1ccc2ccccc2c1)C(C)C
InChIInChI=1S/C19H26N2O/c1-14(2)21(15(3)4)12-11-20-19(22)18-10-9-16-7-5-6-8-17(16)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,20,22)
InChIKeyQFJUWIJFTJYYNG-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.69
Rot. Bonds6

About N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide

N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide (PubChem CID 17461104) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide
PubChem CID17461104
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC NameN-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide
SMILESCC(C)N(CCNC(=O)c1ccc2ccccc2c1)C(C)C
InChIInChI=1S/C19H26N2O/c1-14(2)21(15(3)4)12-11-20-19(22)18-10-9-16-7-5-6-8-17(16)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,20,22)
InChIKeyQFJUWIJFTJYYNG-UHFFFAOYSA-N
XLogP3.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propylnaphthalene-2-carboxamide
CID 6624536
N-[4-(naphthalene-2-carbonylamino)butyl]naphthalene-2-carboxamide
CID 101181857
N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 39466436
N-(3-hydroxy-4-methylpentyl)naphthalene-2-carboxamide
CID 111461088
2-methyl-4-(naphthalene-2-carbonylamino)butanoic acid
CID 80538465
N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 24560136
N-(2-hydroxyethyl)naphthalene-2-carboxamide
CID 13288324
N-(4-aminopentyl)naphthalene-2-carboxamide
CID 106122722
N-(3-propan-2-yloxypropyl)naphthalene-2-carboxamide
CID 110485660
N-[2-[di(propan-2-yl)amino]ethyl]-2-naphthalen-2-yloxyacetamide
CID 8919238
N-pentylnaphthalene-2-carboxamide
CID 91722098
3-[2-methylpropyl-[3-(naphthalene-2-carbonylamino)propanoyl]amino]propanoic acid
CID 119189971

Frequently Asked Questions

What is the IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide?
The IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide (CID 17461104) is N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide is CC(C)N(CCNC(=O)c1ccc2ccccc2c1)C(C)C.
What is the InChIKey of N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide?
The InChIKey is QFJUWIJFTJYYNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-14(2)21(15(3)4)12-11-20-19(22)18-10-9-16-7-5-6-8-17(16)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,20,22).
What are the key properties of N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide?
N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide has a molecular weight of 298.43 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[di(propan-2-yl)amino]ethyl]naphthalene-2-carboxamide is sourced from PubChem (CID 17461104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).