2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine

C17H28N2O2 — CID 60895469

IUPAC2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine
SMILESCOCCN(CCOC)C1(CN)CCc2ccccc2C1
InChIInChI=1S/C17H28N2O2/c1-20-11-9-19(10-12-21-2)17(14-18)8-7-15-5-3-4-6-16(15)13-17/h3-6H,7-14,18H2,1-2H3
InChIKeyYPKYLFZKHOOCGJ-UHFFFAOYSA-N
MW292.42 g/mol
LogP1.47
Rot. Bonds8

About 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine

2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 60895469) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID60895469
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine
SMILESCOCCN(CCOC)C1(CN)CCc2ccccc2C1
InChIInChI=1S/C17H28N2O2/c1-20-11-9-19(10-12-21-2)17(14-18)8-7-15-5-3-4-6-16(15)13-17/h3-6H,7-14,18H2,1-2H3
InChIKeyYPKYLFZKHOOCGJ-UHFFFAOYSA-N
XLogP1.47
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(Dimethylamino)ethyl]-1-(2-methoxyethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea
CID 72145132
N-(2-methoxyethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 2846517
1-(5-Fluoro-2-methylphenyl)-3-methyl-3-morpholin-4-ylbutan-2-amine
CID 105374072
1-(5-Fluoro-2-methylphenyl)-3-methyl-3-morpholin-4-ylpentan-2-amine
CID 105374084
1-(4-Fluoro-2-methylphenyl)-3-methyl-3-morpholin-4-ylbutan-2-amine
CID 114348067
1-(4-Fluoro-2-methylphenyl)-3-methyl-3-morpholin-4-ylpentan-2-amine
CID 114348079
3-(3-fluorophenyl)-2-N,2-N-bis(2-methoxyethyl)-2-methylpropane-1,2-diamine
CID 114831152
3-(2-fluorophenyl)-2-N,2-N-bis(2-methoxyethyl)-2-methylpropane-1,2-diamine
CID 114831153
3-(4-fluorophenyl)-2-N,2-N-bis(2-methoxyethyl)-2-methylpropane-1,2-diamine
CID 114831154
(2S)-2-(aminomethyl)-N-methyl-3,4-dihydro-1H-naphthalen-2-amine
CID 58466703
N-(2-methoxyethyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 59006430
N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 59535616

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine (CID 60895469) is 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine is COCCN(CCOC)C1(CN)CCc2ccccc2C1.
What is the InChIKey of 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is YPKYLFZKHOOCGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-20-11-9-19(10-12-21-2)17(14-18)8-7-15-5-3-4-6-16(15)13-17/h3-6H,7-14,18H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine?
2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 292.42 g/mol, XLogP of 1.47, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,N-bis(2-methoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 60895469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).