2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine

C18H25NO — CID 79626422

IUPAC2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCC(C)(C)COc1ccc2ccccc2c1
InChIInChI=1S/C18H25NO/c1-14(2)19-12-18(3,4)13-20-17-10-9-15-7-5-6-8-16(15)11-17/h5-11,14,19H,12-13H2,1-4H3
InChIKeyBJPGAXQSHJKVEE-UHFFFAOYSA-N
MW271.40 g/mol
LogP4.24
Rot. Bonds6

About 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine

2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine (PubChem CID 79626422) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine
PubChem CID79626422
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC Name2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCC(C)(C)COc1ccc2ccccc2c1
InChIInChI=1S/C18H25NO/c1-14(2)19-12-18(3,4)13-20-17-10-9-15-7-5-6-8-16(15)11-17/h5-11,14,19H,12-13H2,1-4H3
InChIKeyBJPGAXQSHJKVEE-UHFFFAOYSA-N
XLogP4.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-tert-butylphenoxy)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 79628807
3-(4-tert-butylphenoxy)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 79626396
3-(4-ethylphenoxy)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 79626545
3-(4-chloronaphthalen-1-yl)oxy-2,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 79621008
3-(6-bromonaphthalen-2-yl)oxy-N,2,2-trimethylpropan-1-amine
CID 79628620
2-(2,2,2-trifluoroethoxy)naphthalene
CID 21269180
2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine
CID 79626684
2,2-dimethyl-3-(3-phenylprop-2-enoxy)-N-propan-2-ylpropan-1-amine
CID 79627713
1-naphthalen-2-yloxypropan-2-ol
CID 2793897
2-ethoxynaphthalene
CID 118978197
3-(2-methoxy-4-methylphenoxy)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 79626692
N,2,2-trimethyl-3-quinolin-3-yloxypropan-1-amine
CID 107387869

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine (CID 79626422) is 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine is CC(C)NCC(C)(C)COc1ccc2ccccc2c1.
What is the InChIKey of 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine?
The InChIKey is BJPGAXQSHJKVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO/c1-14(2)19-12-18(3,4)13-20-17-10-9-15-7-5-6-8-16(15)11-17/h5-11,14,19H,12-13H2,1-4H3.
What are the key properties of 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine?
2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine has a molecular weight of 271.40 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 79626422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).