4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine

C15H23N3 — CID 7446094

IUPAC4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine
SMILESCN1CCN(N[C@@H]2CCc3ccccc3C2)CC1
InChIInChI=1S/C15H23N3/c1-17-8-10-18(11-9-17)16-15-7-6-13-4-2-3-5-14(13)12-15/h2-5,15-16H,6-12H2,1H3/t15-/m1/s1
InChIKeyQSFWHKPHNUQYAP-OAHLLOKOSA-N
MW245.37 g/mol
LogP1.30
Rot. Bonds2

About 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine

4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine (PubChem CID 7446094) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine.

Molecular Properties

Compound Name4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine
PubChem CID7446094
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine
SMILESCN1CCN(N[C@@H]2CCc3ccccc3C2)CC1
InChIInChI=1S/C15H23N3/c1-17-8-10-18(11-9-17)16-15-7-6-13-4-2-3-5-14(13)12-15/h2-5,15-16H,6-12H2,1H3/t15-/m1/s1
InChIKeyQSFWHKPHNUQYAP-OAHLLOKOSA-N
XLogP1.30
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine?
The IUPAC name of 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine (CID 7446094) is 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine.
What is the SMILES notation for 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine?
The canonical SMILES for 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine is CN1CCN(N[C@@H]2CCc3ccccc3C2)CC1.
What is the InChIKey of 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine?
The InChIKey is QSFWHKPHNUQYAP-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H23N3/c1-17-8-10-18(11-9-17)16-15-7-6-13-4-2-3-5-14(13)12-15/h2-5,15-16H,6-12H2,1H3/t15-/m1/s1.
What are the key properties of 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine?
4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine has a molecular weight of 245.37 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-amine is sourced from PubChem (CID 7446094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).