N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

C15H22N2O — CID 103512711

IUPACN-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESCNC(C)CNC(=O)C1CCCc2ccccc21
InChIInChI=1S/C15H22N2O/c1-11(16-2)10-17-15(18)14-9-5-7-12-6-3-4-8-13(12)14/h3-4,6,8,11,14,16H,5,7,9-10H2,1-2H3,(H,17,18)
InChIKeyUZLSXXJHZCSFAM-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.83
Rot. Bonds4

About N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide (PubChem CID 103512711) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
PubChem CID103512711
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESCNC(C)CNC(=O)C1CCCc2ccccc21
InChIInChI=1S/C15H22N2O/c1-11(16-2)10-17-15(18)14-9-5-7-12-6-3-4-8-13(12)14/h3-4,6,8,11,14,16H,5,7,9-10H2,1-2H3,(H,17,18)
InChIKeyUZLSXXJHZCSFAM-UHFFFAOYSA-N
XLogP1.83
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-3-(1,2,3,4-tetrahydronaphthalene-1-carbonylamino)propanoic acid
CID 62674806
N-(3-bromo-2-methylpropyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 114313424
N-(2-hydroxybutyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 113492689
N-(2-chloro-3-methoxypropyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 113272066
N-(2-chloropentyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 113496484
N-[2-(methylamino)propyl]-3,4-dihydro-2H-chromene-4-carboxamide
CID 103512642
(1R)-N-[(2R)-2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 39977633
N-(3,3-dimethyl-2-oxobutyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 64991886
N-(3-oxobutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 64996915
N-(4-hydroxy-3-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 115734909
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 79245874
N-(5-hydroxypentyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 107318401

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The IUPAC name of N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide (CID 103512711) is N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide.
What is the SMILES notation for N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The canonical SMILES for N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide is CNC(C)CNC(=O)C1CCCc2ccccc21.
What is the InChIKey of N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The InChIKey is UZLSXXJHZCSFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11(16-2)10-17-15(18)14-9-5-7-12-6-3-4-8-13(12)14/h3-4,6,8,11,14,16H,5,7,9-10H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)propyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide is sourced from PubChem (CID 103512711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).