3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine

C13H17N — CID 76997136

IUPAC3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine
SMILESNCCC=C1CCCc2ccccc21
InChIInChI=1S/C13H17N/c14-10-4-8-12-7-3-6-11-5-1-2-9-13(11)12/h1-2,5,8-9H,3-4,6-7,10,14H2
InChIKeyWSTRAVZAUUGGQZ-UHFFFAOYSA-N
MW187.29 g/mol
LogP2.76
Rot. Bonds2

About 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine

3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine (PubChem CID 76997136) has the molecular formula C13H17N and a molecular weight of 187.29 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine
PubChem CID76997136
Molecular FormulaC13H17N
Molecular Weight187.29 g/mol
Exact Mass187.14
IUPAC Name3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine
SMILESNCCC=C1CCCc2ccccc21
InChIInChI=1S/C13H17N/c14-10-4-8-12-7-3-6-11-5-1-2-9-13(11)12/h1-2,5,8-9H,3-4,6-7,10,14H2
InChIKeyWSTRAVZAUUGGQZ-UHFFFAOYSA-N
XLogP2.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-butylidene-2,3-dihydro-1H-naphthalene
CID 123805104
(3Z)-3-(6,7-dihydro-5H-1-benzofuran-4-ylidene)propan-1-amine
CID 115467399
ethane;(3E)-3-propylidene-1,2-dihydroindene
CID 143438466
(1Z)-1-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-2-ol
CID 103971061
(1E)-1-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-2-one
CID 142003176
2,3-dihydro-1H-indene;propan-1-amine
CID 18516594
(E,4Z)-4-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)but-2-enal
CID 19013076
3-[(Z)-3,4-dihydro-2H-naphthalen-1-ylidenemethyl]pyridine
CID 6539762
(3Z)-3-[6-ethenyl-7-[(Z)-prop-1-enyl]-8,9-dihydrobenzo[7]annulen-5-ylidene]propan-1-amine
CID 143127856
2-(7-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethanamine
CID 54094556
5-amino-8,9-dihydro-7H-benzo[7]annulene-6-carbonitrile
CID 139221321
ethane-1,2-diamine;9H-fluorene
CID 159422270

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine?
The IUPAC name of 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine (CID 76997136) is 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine.
What is the SMILES notation for 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine?
The canonical SMILES for 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine is NCCC=C1CCCc2ccccc21.
What is the InChIKey of 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine?
The InChIKey is WSTRAVZAUUGGQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N/c14-10-4-8-12-7-3-6-11-5-1-2-9-13(11)12/h1-2,5,8-9H,3-4,6-7,10,14H2.
What are the key properties of 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine?
3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine has a molecular weight of 187.29 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-naphthalen-1-ylidene)propan-1-amine is sourced from PubChem (CID 76997136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).