1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine

C19H23N — CID 63528750

IUPAC1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine
SMILESNC(Cc1cccc2ccccc12)C1CC2CCC1C2
InChIInChI=1S/C19H23N/c20-19(18-11-13-8-9-16(18)10-13)12-15-6-3-5-14-4-1-2-7-17(14)15/h1-7,13,16,18-19H,8-12,20H2
InChIKeyBVNYEZJBLCMQIQ-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.15
Rot. Bonds3

About 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine

1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine (PubChem CID 63528750) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine.

Molecular Properties

Compound Name1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine
PubChem CID63528750
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine
SMILESNC(Cc1cccc2ccccc12)C1CC2CCC1C2
InChIInChI=1S/C19H23N/c20-19(18-11-13-8-9-16(18)10-13)12-15-6-3-5-14-4-1-2-7-17(14)15/h1-7,13,16,18-19H,8-12,20H2
InChIKeyBVNYEZJBLCMQIQ-UHFFFAOYSA-N
XLogP4.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bicyclo[2.2.1]heptanyl)-N-(naphthalen-1-ylmethyl)ethanamine
CID 43081550
1-(2-bicyclo[2.2.1]heptanyl)-3-naphthalen-1-ylpropan-2-ol
CID 63519467
[2-bicyclo[2.2.1]heptanyl(naphthalen-1-yl)methyl]hydrazine
CID 105266833
1-(3-methylcyclopentyl)-2-naphthalen-1-ylethanamine
CID 65413962
1-(2-bicyclo[2.2.1]heptanyl)-2-(2-fluorophenyl)ethanol
CID 63017529
2-naphthalen-1-yl-1-(thiolan-3-yl)ethanamine
CID 105131271
2-(2-bicyclo[2.2.1]heptanyl)-3-(2-bromophenyl)propan-1-amine
CID 114246245
1-(2-bicyclo[2.2.1]heptanyl)-2-(2-fluorophenyl)sulfanylethanamine
CID 114245897
1-(2-bicyclo[2.2.1]heptanyl)-2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethanamine
CID 113383497
1-(1,1-dioxothiolan-3-yl)-2-naphthalen-1-ylethanamine
CID 64905999
(2S)-2-amino-3-naphthalen-1-ylpropan-1-ol
CID 57252069
1-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-naphthalen-1-ylurea
CID 18285320

Frequently Asked Questions

What is the IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine?
The IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine (CID 63528750) is 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine.
What is the SMILES notation for 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine?
The canonical SMILES for 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine is NC(Cc1cccc2ccccc12)C1CC2CCC1C2.
What is the InChIKey of 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine?
The InChIKey is BVNYEZJBLCMQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c20-19(18-11-13-8-9-16(18)10-13)12-15-6-3-5-14-4-1-2-7-17(14)15/h1-7,13,16,18-19H,8-12,20H2.
What are the key properties of 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine?
1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine has a molecular weight of 265.40 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bicyclo[2.2.1]heptanyl)-2-naphthalen-1-ylethanamine is sourced from PubChem (CID 63528750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).