N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine

C17H23NO — CID 164783421

IUPACN-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine
SMILESCC(C)Nc1ccc2cc(COC(C)C)ccc2c1
InChIInChI=1S/C17H23NO/c1-12(2)18-17-8-7-15-9-14(11-19-13(3)4)5-6-16(15)10-17/h5-10,12-13,18H,11H2,1-4H3
InChIKeyGVVRWBMIYUCEFZ-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.59
Rot. Bonds5

About N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine

N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine (PubChem CID 164783421) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine
PubChem CID164783421
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC NameN-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine
SMILESCC(C)Nc1ccc2cc(COC(C)C)ccc2c1
InChIInChI=1S/C17H23NO/c1-12(2)18-17-8-7-15-9-14(11-19-13(3)4)5-6-16(15)10-17/h5-10,12-13,18H,11H2,1-4H3
InChIKeyGVVRWBMIYUCEFZ-UHFFFAOYSA-N
XLogP4.59
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[6-(propan-2-ylamino)naphthalen-2-yl]methoxy]ethanethiol
CID 170094565
2,7-bis(propan-2-yloxymethyl)anthracene
CID 176781411
6-(2-methylpropyl)-N-propan-2-ylnaphthalen-2-amine
CID 165158120
N-butan-2-yl-4-(propan-2-yloxymethyl)aniline
CID 115919101
ethane;N-ethyl-4-(propan-2-yloxymethyl)aniline
CID 176948818
6-(propan-2-yloxymethyl)-1-benzofuran
CID 171518537
5-(propan-2-yloxymethyl)-1-benzofuran
CID 166645966
1-[2,4-bis(propan-2-yloxymethyl)phenyl]-2,4-bis(propan-2-yloxymethyl)benzene
CID 139792803
1-(methoxymethyl)-4-(propan-2-yloxymethyl)benzene
CID 70670788
4-[(4-methylphenyl)methoxy]-N-propan-2-ylaniline
CID 155469533
4-(2-methylpropyl)-N-propan-2-ylaniline;[4-(propan-2-ylamino)phenyl]methyl 2-methylpropanoate;2-(propan-2-yldisulfanyl)propane;N-propan-2-yl-4-(propan-2-yloxymethyl)aniline
CID 159691693
2-methyl-5-(propan-2-yloxymethyl)phenol
CID 117222042

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine?
The IUPAC name of N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine (CID 164783421) is N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine.
What is the SMILES notation for N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine?
The canonical SMILES for N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine is CC(C)Nc1ccc2cc(COC(C)C)ccc2c1.
What is the InChIKey of N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine?
The InChIKey is GVVRWBMIYUCEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-12(2)18-17-8-7-15-9-14(11-19-13(3)4)5-6-16(15)10-17/h5-10,12-13,18H,11H2,1-4H3.
What are the key properties of N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine?
N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine has a molecular weight of 257.38 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-6-(propan-2-yloxymethyl)naphthalen-2-amine is sourced from PubChem (CID 164783421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).