N-ethyl-3-naphthalen-2-yloxyheptan-4-amine

C19H27NO — CID 63475073

IUPACN-ethyl-3-naphthalen-2-yloxyheptan-4-amine
SMILESCCCC(NCC)C(CC)Oc1ccc2ccccc2c1
InChIInChI=1S/C19H27NO/c1-4-9-18(20-6-3)19(5-2)21-17-13-12-15-10-7-8-11-16(15)14-17/h7-8,10-14,18-20H,4-6,9H2,1-3H3
InChIKeyZADUXFRBAJQQTC-UHFFFAOYSA-N
MW285.43 g/mol
LogP4.78
Rot. Bonds8

About N-ethyl-3-naphthalen-2-yloxyheptan-4-amine

N-ethyl-3-naphthalen-2-yloxyheptan-4-amine (PubChem CID 63475073) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is N-ethyl-3-naphthalen-2-yloxyheptan-4-amine.

Molecular Properties

Compound NameN-ethyl-3-naphthalen-2-yloxyheptan-4-amine
PubChem CID63475073
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC NameN-ethyl-3-naphthalen-2-yloxyheptan-4-amine
SMILESCCCC(NCC)C(CC)Oc1ccc2ccccc2c1
InChIInChI=1S/C19H27NO/c1-4-9-18(20-6-3)19(5-2)21-17-13-12-15-10-7-8-11-16(15)14-17/h7-8,10-14,18-20H,4-6,9H2,1-3H3
InChIKeyZADUXFRBAJQQTC-UHFFFAOYSA-N
XLogP4.78
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-naphthalen-2-ylbutan-1-amine
CID 62716918
(3R)-N-methyl-3-naphthalen-2-yloxyhexan-1-amine;hydrochloride
CID 11609028
2-naphthalen-2-yloxy-N-propylpropan-1-amine
CID 42630142
2-naphthalen-2-yloxypentanehydrazide
CID 54792972
N-ethyl-3-phenylheptan-4-amine
CID 83051533
5-naphthalen-2-yloxyheptan-1-amine
CID 68866838
ethyl (2R)-2-naphthalen-2-yloxypropanoate
CID 842728
4-naphthalen-2-yloxypentan-1-amine
CID 55076664
(2S)-2-naphthalen-2-yloxy-N-pentylbutanamide
CID 92647112
N-hydroxy-2-naphthalen-2-yloxyundecanamide
CID 14032482
N-ethyl-1-naphthalen-2-ylheptan-2-amine
CID 63527367
4-naphthalen-2-yloxypentan-2-ol
CID 64720616

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-naphthalen-2-yloxyheptan-4-amine?
The IUPAC name of N-ethyl-3-naphthalen-2-yloxyheptan-4-amine (CID 63475073) is N-ethyl-3-naphthalen-2-yloxyheptan-4-amine.
What is the SMILES notation for N-ethyl-3-naphthalen-2-yloxyheptan-4-amine?
The canonical SMILES for N-ethyl-3-naphthalen-2-yloxyheptan-4-amine is CCCC(NCC)C(CC)Oc1ccc2ccccc2c1.
What is the InChIKey of N-ethyl-3-naphthalen-2-yloxyheptan-4-amine?
The InChIKey is ZADUXFRBAJQQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-4-9-18(20-6-3)19(5-2)21-17-13-12-15-10-7-8-11-16(15)14-17/h7-8,10-14,18-20H,4-6,9H2,1-3H3.
What are the key properties of N-ethyl-3-naphthalen-2-yloxyheptan-4-amine?
N-ethyl-3-naphthalen-2-yloxyheptan-4-amine has a molecular weight of 285.43 g/mol, XLogP of 4.78, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-naphthalen-2-yloxyheptan-4-amine is sourced from PubChem (CID 63475073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).