N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine

C12H15N — CID 89374740

IUPACN,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine
SMILESC=C1CCc2ccc(N(C)C)cc21
InChIInChI=1S/C12H15N/c1-9-4-5-10-6-7-11(13(2)3)8-12(9)10/h6-8H,1,4-5H2,2-3H3
InChIKeyLVRJWSWQFDWBCS-UHFFFAOYSA-N
MW173.26 g/mol
LogP2.71
Rot. Bonds1

About N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine

N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine (PubChem CID 89374740) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine
PubChem CID89374740
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC NameN,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine
SMILESC=C1CCc2ccc(N(C)C)cc21
InChIInChI=1S/C12H15N/c1-9-4-5-10-6-7-11(13(2)3)8-12(9)10/h6-8H,1,4-5H2,2-3H3
InChIKeyLVRJWSWQFDWBCS-UHFFFAOYSA-N
XLogP2.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine?
The IUPAC name of N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine (CID 89374740) is N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine.
What is the SMILES notation for N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine?
The canonical SMILES for N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine is C=C1CCc2ccc(N(C)C)cc21.
What is the InChIKey of N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine?
The InChIKey is LVRJWSWQFDWBCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-9-4-5-10-6-7-11(13(2)3)8-12(9)10/h6-8H,1,4-5H2,2-3H3.
What are the key properties of N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine?
N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine has a molecular weight of 173.26 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-methylidene-1,2-dihydroinden-5-amine is sourced from PubChem (CID 89374740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).