2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide

C16H24N2O — CID 115532003

IUPAC2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide
SMILESCC(C)(NC1c2ccccc2CCC1(C)C)C(N)=O
InChIInChI=1S/C16H24N2O/c1-15(2)10-9-11-7-5-6-8-12(11)13(15)18-16(3,4)14(17)19/h5-8,13,18H,9-10H2,1-4H3,(H2,17,19)
InChIKeyICBVRAROVDNOLO-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.55
Rot. Bonds3

About 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide

2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide (PubChem CID 115532003) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide
PubChem CID115532003
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide
SMILESCC(C)(NC1c2ccccc2CCC1(C)C)C(N)=O
InChIInChI=1S/C16H24N2O/c1-15(2)10-9-11-7-5-6-8-12(11)13(15)18-16(3,4)14(17)19/h5-8,13,18H,9-10H2,1-4H3,(H2,17,19)
InChIKeyICBVRAROVDNOLO-UHFFFAOYSA-N
XLogP2.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-N-(2-methylbut-3-yn-2-yl)-3,4-dihydro-1H-naphthalen-1-amine
CID 113329802
methyl (2S)-2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]propanoate
CID 115531954
3-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropane-1,2-diol
CID 115532149
2,2-dimethyl-N-(2,2,2-trifluoroethyl)-3,4-dihydro-1H-naphthalen-1-amine
CID 113329778
3-[(2,2-dimethyl-1,3-dihydroinden-1-yl)amino]-2,2-dimethylpropanamide
CID 106274962
N-(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)-4-methylpiperazin-1-amine
CID 83010508
1-N-(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 115531864
4-N-(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)cyclohexane-1,4-diamine
CID 115532055
3-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]propan-1-ol
CID 113329785
(2R)-1-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]propan-2-ol
CID 114266891
N'-(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)propane-1,3-diamine
CID 113329793
2-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl)amino]propanamide
CID 103313209

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide?
The IUPAC name of 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide (CID 115532003) is 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide.
What is the SMILES notation for 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide?
The canonical SMILES for 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide is CC(C)(NC1c2ccccc2CCC1(C)C)C(N)=O.
What is the InChIKey of 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide?
The InChIKey is ICBVRAROVDNOLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-15(2)10-9-11-7-5-6-8-12(11)13(15)18-16(3,4)14(17)19/h5-8,13,18H,9-10H2,1-4H3,(H2,17,19).
What are the key properties of 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide?
2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]-2-methylpropanamide is sourced from PubChem (CID 115532003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).