N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine

C11H15N — CID 20675200

IUPACN,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine
SMILESCN(C)C1=CCC2C=CC=CC12
InChIInChI=1S/C11H15N/c1-12(2)11-8-7-9-5-3-4-6-10(9)11/h3-6,8-10H,7H2,1-2H3
InChIKeyOPNXKKBXOFRPEJ-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.19
Rot. Bonds1

About N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine

N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine (PubChem CID 20675200) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine
PubChem CID20675200
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC NameN,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine
SMILESCN(C)C1=CCC2C=CC=CC12
InChIInChI=1S/C11H15N/c1-12(2)11-8-7-9-5-3-4-6-10(9)11/h3-6,8-10H,7H2,1-2H3
InChIKeyOPNXKKBXOFRPEJ-UHFFFAOYSA-N
XLogP2.19
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine?
The IUPAC name of N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine (CID 20675200) is N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine.
What is the SMILES notation for N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine?
The canonical SMILES for N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine is CN(C)C1=CCC2C=CC=CC12.
What is the InChIKey of N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine?
The InChIKey is OPNXKKBXOFRPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-12(2)11-8-7-9-5-3-4-6-10(9)11/h3-6,8-10H,7H2,1-2H3.
What are the key properties of N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine?
N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine has a molecular weight of 161.25 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3a,7a-dihydro-3H-inden-1-amine is sourced from PubChem (CID 20675200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).