2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide

C18H23NO — CID 15828026

IUPAC2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide
SMILESCc1ccc2ccccc2c1C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C18H23NO/c1-12(2)19(13(3)4)18(20)17-14(5)10-11-15-8-6-7-9-16(15)17/h6-13H,1-5H3
InChIKeyJHZSHWRPRFZHER-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.41
Rot. Bonds3

About 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide

2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide (PubChem CID 15828026) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide.

Molecular Properties

Compound Name2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide
PubChem CID15828026
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide
SMILESCc1ccc2ccccc2c1C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C18H23NO/c1-12(2)19(13(3)4)18(20)17-14(5)10-11-15-8-6-7-9-16(15)17/h6-13H,1-5H3
InChIKeyJHZSHWRPRFZHER-UHFFFAOYSA-N
XLogP4.41
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2R)-butan-2-yl]-N,N-di(propan-2-yl)naphthalene-1-carboxamide
CID 102067521
N,N-di(propan-2-yl)-2-[(1R)-1-trimethylsilylethyl]naphthalene-1-carboxamide
CID 101183302
2-[(2S)-3-hydroxy-3-methylbutan-2-yl]-N,N-di(propan-2-yl)naphthalene-1-carboxamide
CID 102067522
2-[dihydroxy-(2,4,6-trimethylphenyl)silyl]-N,N-di(propan-2-yl)naphthalene-1-carboxamide
CID 102459740
2-chloro-1-(2-methylnaphthalen-1-yl)butan-1-one
CID 146007450
1-(2-methylnaphthalen-1-yl)-2-methylsulfonylethanone
CID 81428930
(2-iodophenyl)-(2-methylnaphthalen-1-yl)methanone
CID 81430773
(4-bromophenyl)-(2-methylnaphthalen-1-yl)methanone
CID 81430357
2-methyl-1-prop-1-en-2-ylnaphthalene
CID 123573503
(4-chlorophenyl)-(2-methylnaphthalen-1-yl)methanone
CID 71481457
cis-(1S,2R)-2-[(1S)-1-[1-[di(propan-2-yl)carbamoyl]naphthalen-2-yl]ethoxy]carbonylcyclohexane-1-carboxylic acid
CID 11351488
2-O-[(1S)-1-[1-[di(propan-2-yl)carbamoyl]naphthalen-2-yl]ethyl] 1-O-methyl (1R,2S)-cyclohex-4-ene-1,2-dicarboxylate
CID 101148936

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
The IUPAC name of 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide (CID 15828026) is 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide.
What is the SMILES notation for 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
The canonical SMILES for 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide is Cc1ccc2ccccc2c1C(=O)N(C(C)C)C(C)C.
What is the InChIKey of 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
The InChIKey is JHZSHWRPRFZHER-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-12(2)19(13(3)4)18(20)17-14(5)10-11-15-8-6-7-9-16(15)17/h6-13H,1-5H3.
What are the key properties of 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide is sourced from PubChem (CID 15828026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).