N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine

C19H27NO — CID 116761218

IUPACN,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine
SMILESCCNC(c1ccc2ccccc2c1)C(CC)(CC)OC
InChIInChI=1S/C19H27NO/c1-5-19(6-2,21-4)18(20-7-3)17-13-12-15-10-8-9-11-16(15)14-17/h8-14,18,20H,5-7H2,1-4H3
InChIKeyDDMQGONLAMOVDX-UHFFFAOYSA-N
MW285.43 g/mol
LogP4.70
Rot. Bonds7

About N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine

N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine (PubChem CID 116761218) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine.

Molecular Properties

Compound NameN,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine
PubChem CID116761218
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC NameN,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine
SMILESCCNC(c1ccc2ccccc2c1)C(CC)(CC)OC
InChIInChI=1S/C19H27NO/c1-5-19(6-2,21-4)18(20-7-3)17-13-12-15-10-8-9-11-16(15)14-17/h8-14,18,20H,5-7H2,1-4H3
InChIKeyDDMQGONLAMOVDX-UHFFFAOYSA-N
XLogP4.70
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethoxyphenyl)-N,2-diethyl-2-methoxybutan-1-amine
CID 116761096
2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 79196999
2,2-dimethyl-1-naphthalen-2-yl-N-propylbutan-1-amine
CID 115851112
2,2-dimethyl-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 63413588
N-ethyl-1-naphthalen-2-ylbutan-1-amine
CID 62716918
(2-ethyl-2-methoxy-1-quinolin-7-ylbutyl)hydrazine
CID 105275332
N-ethyl-2,3-dimethyl-1-naphthalen-2-ylbutan-1-amine
CID 115851123
2-ethyl-1-N,2-N,2-N-trimethyl-1-naphthalen-2-ylbutane-1,2-diamine
CID 79058618
N-ethyl-2-(3-methoxypropylsulfanyl)-1-naphthalen-2-ylethanamine
CID 64626467
N-ethyl-4-methyl-1-naphthalen-2-ylpentan-1-amine
CID 63417061
1-(6-bromonaphthalen-2-yl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 115854226
[2-ethyl-2-methoxy-1-(4-methoxyphenyl)butyl]hydrazine
CID 105275411

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine?
The IUPAC name of N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine (CID 116761218) is N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine.
What is the SMILES notation for N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine?
The canonical SMILES for N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine is CCNC(c1ccc2ccccc2c1)C(CC)(CC)OC.
What is the InChIKey of N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine?
The InChIKey is DDMQGONLAMOVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-5-19(6-2,21-4)18(20-7-3)17-13-12-15-10-8-9-11-16(15)14-17/h8-14,18,20H,5-7H2,1-4H3.
What are the key properties of N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine?
N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine has a molecular weight of 285.43 g/mol, XLogP of 4.70, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine is sourced from PubChem (CID 116761218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).