3-naphthalen-2-ylprop-2-en-1-amine

C13H13N — CID 76997157

IUPAC3-naphthalen-2-ylprop-2-en-1-amine
SMILESNCC=Cc1ccc2ccccc2c1
InChIInChI=1S/C13H13N/c14-9-3-4-11-7-8-12-5-1-2-6-13(12)10-11/h1-8,10H,9,14H2
InChIKeyVDVQQKYYGQCMKR-UHFFFAOYSA-N
MW183.25 g/mol
LogP2.81
Rot. Bonds2

About 3-naphthalen-2-ylprop-2-en-1-amine

3-naphthalen-2-ylprop-2-en-1-amine (PubChem CID 76997157) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is 3-naphthalen-2-ylprop-2-en-1-amine.

Molecular Properties

Compound Name3-naphthalen-2-ylprop-2-en-1-amine
PubChem CID76997157
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name3-naphthalen-2-ylprop-2-en-1-amine
SMILESNCC=Cc1ccc2ccccc2c1
InChIInChI=1S/C13H13N/c14-9-3-4-11-7-8-12-5-1-2-6-13(12)10-11/h1-8,10H,9,14H2
InChIKeyVDVQQKYYGQCMKR-UHFFFAOYSA-N
XLogP2.81
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(E)-3-chloroprop-1-enyl]naphthalene
CID 12965767
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
4-naphthalen-2-ylbut-3-en-1-ol
CID 54291326
(E)-3-isoquinolin-7-ylprop-2-en-1-amine
CID 117279909
2-[(E)-4-methylpent-1-enyl]naphthalene
CID 15318830
(E)-5-naphthalen-2-ylpent-4-en-1-ol
CID 11252836
2-[(Z)-2-anthracen-2-ylethenyl]anthracene
CID 101144533
2-[4-[(E)-2-naphthalen-2-ylethenyl]pyridin-1-ium-1-yl]ethanamine
CID 23757809
2-naphthalen-2-ylethenol
CID 67195423
2-(2-naphthalen-2-ylethynyl)-6-[(E)-2-[6-(2-naphthalen-2-ylethynyl)naphthalen-2-yl]ethenyl]naphthalene
CID 59413225
2-[(E)-docos-1-enyl]naphthalene
CID 101307759
(E)-5-naphthalen-2-ylpent-4-enoic acid
CID 10263103

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-ylprop-2-en-1-amine?
The IUPAC name of 3-naphthalen-2-ylprop-2-en-1-amine (CID 76997157) is 3-naphthalen-2-ylprop-2-en-1-amine.
What is the SMILES notation for 3-naphthalen-2-ylprop-2-en-1-amine?
The canonical SMILES for 3-naphthalen-2-ylprop-2-en-1-amine is NCC=Cc1ccc2ccccc2c1.
What is the InChIKey of 3-naphthalen-2-ylprop-2-en-1-amine?
The InChIKey is VDVQQKYYGQCMKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N/c14-9-3-4-11-7-8-12-5-1-2-6-13(12)10-11/h1-8,10H,9,14H2.
What are the key properties of 3-naphthalen-2-ylprop-2-en-1-amine?
3-naphthalen-2-ylprop-2-en-1-amine has a molecular weight of 183.25 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-ylprop-2-en-1-amine is sourced from PubChem (CID 76997157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).