N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

C19H21NO — CID 42884040

IUPACN,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
SMILESCc1ccc(C(=O)N(C)C2CCCc3ccccc32)cc1
InChIInChI=1S/C19H21NO/c1-14-10-12-16(13-11-14)19(21)20(2)18-9-5-7-15-6-3-4-8-17(15)18/h3-4,6,8,10-13,18H,5,7,9H2,1-2H3
InChIKeyPYKDVGJVLRKIMB-UHFFFAOYSA-N
MW279.38 g/mol
LogP4.14
Rot. Bonds2

About N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide (PubChem CID 42884040) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide.

Molecular Properties

Compound NameN,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
PubChem CID42884040
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC NameN,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
SMILESCc1ccc(C(=O)N(C)C2CCCc3ccccc32)cc1
InChIInChI=1S/C19H21NO/c1-14-10-12-16(13-11-14)19(21)20(2)18-9-5-7-15-6-3-4-8-17(15)18/h3-4,6,8,10-13,18H,5,7,9H2,1-2H3
InChIKeyPYKDVGJVLRKIMB-UHFFFAOYSA-N
XLogP4.14
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
The IUPAC name of N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide (CID 42884040) is N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide.
What is the SMILES notation for N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
The canonical SMILES for N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide is Cc1ccc(C(=O)N(C)C2CCCc3ccccc32)cc1.
What is the InChIKey of N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
The InChIKey is PYKDVGJVLRKIMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-14-10-12-16(13-11-14)19(21)20(2)18-9-5-7-15-6-3-4-8-17(15)18/h3-4,6,8,10-13,18H,5,7,9H2,1-2H3.
What are the key properties of N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide?
N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide has a molecular weight of 279.38 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide is sourced from PubChem (CID 42884040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).