2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol

C17H23NO — CID 115135288

IUPAC2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol
SMILESCc1ccc2cc(N(C)CC(C)(C)CO)ccc2c1
InChIInChI=1S/C17H23NO/c1-13-5-6-15-10-16(8-7-14(15)9-13)18(4)11-17(2,3)12-19/h5-10,19H,11-12H2,1-4H3
InChIKeyAKWMECYFWLIIRW-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.60
Rot. Bonds4

About 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol

2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol (PubChem CID 115135288) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol
PubChem CID115135288
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC Name2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol
SMILESCc1ccc2cc(N(C)CC(C)(C)CO)ccc2c1
InChIInChI=1S/C17H23NO/c1-13-5-6-15-10-16(8-7-14(15)9-13)18(4)11-17(2,3)12-19/h5-10,19H,11-12H2,1-4H3
InChIKeyAKWMECYFWLIIRW-UHFFFAOYSA-N
XLogP3.60
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-3-[methyl(naphthalen-2-yl)amino]propan-1-ol
CID 115135292
3-(4-methoxy-N,3-dimethylanilino)-2,2-dimethylpropan-1-ol
CID 115135188
3-(4-tert-butyl-N-methylanilino)-2,2-dimethylpropan-1-ol
CID 115135181
3-(3-chloro-4-methoxy-N-methylanilino)-2,2-dimethylpropan-1-ol
CID 115135194
2,2-dimethyl-3-[(6-methylnaphthalen-2-yl)amino]propan-1-ol
CID 115135171
6-[(3-hydroxy-2,2-dimethylpropyl)-methylamino]-3H-1,3-benzoxazol-2-one
CID 115135265
2,2-dimethyl-3-[methyl-[(3-methylphenyl)methyl]amino]propan-1-ol
CID 62266896
3-(N-ethyl-3-methylanilino)-2,2-dimethylpropan-1-ol
CID 62272248
N,N',2,2-tetramethyl-N-(3-methylphenyl)propane-1,3-diamine
CID 62258877
N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine
CID 115245749
3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol
CID 64792128
2,6-dimethylnaphthalene;propane
CID 142191183

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol?
The IUPAC name of 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol (CID 115135288) is 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol is Cc1ccc2cc(N(C)CC(C)(C)CO)ccc2c1.
What is the InChIKey of 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol?
The InChIKey is AKWMECYFWLIIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-13-5-6-15-10-16(8-7-14(15)9-13)18(4)11-17(2,3)12-19/h5-10,19H,11-12H2,1-4H3.
What are the key properties of 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol?
2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol has a molecular weight of 257.38 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-[methyl-(6-methylnaphthalen-2-yl)amino]propan-1-ol is sourced from PubChem (CID 115135288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).