3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine

C14H21N — CID 112546993

IUPAC3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine
SMILESCc1cccc2c1CCC(CCCN)C2
InChIInChI=1S/C14H21N/c1-11-4-2-6-13-10-12(5-3-9-15)7-8-14(11)13/h2,4,6,12H,3,5,7-10,15H2,1H3
InChIKeyGLDNBBHCKCMSKY-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.84
Rot. Bonds3

About 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine

3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine (PubChem CID 112546993) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine.

Molecular Properties

Compound Name3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine
PubChem CID112546993
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine
SMILESCc1cccc2c1CCC(CCCN)C2
InChIInChI=1S/C14H21N/c1-11-4-2-6-13-10-12(5-3-9-15)7-8-14(11)13/h2,4,6,12H,3,5,7-10,15H2,1H3
InChIKeyGLDNBBHCKCMSKY-UHFFFAOYSA-N
XLogP2.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine?
The IUPAC name of 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine (CID 112546993) is 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine.
What is the SMILES notation for 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine?
The canonical SMILES for 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine is Cc1cccc2c1CCC(CCCN)C2.
What is the InChIKey of 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine?
The InChIKey is GLDNBBHCKCMSKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-11-4-2-6-13-10-12(5-3-9-15)7-8-14(11)13/h2,4,6,12H,3,5,7-10,15H2,1H3.
What are the key properties of 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine?
3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-amine is sourced from PubChem (CID 112546993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).