1-(3H-inden-1-yl)-N,N-dimethylmethanamine

C12H15N — CID 20658444

IUPAC1-(3H-inden-1-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1=CCc2ccccc21
InChIInChI=1S/C12H15N/c1-13(2)9-11-8-7-10-5-3-4-6-12(10)11/h3-6,8H,7,9H2,1-2H3
InChIKeySSLHXZSPWIDYRF-UHFFFAOYSA-N
MW173.26 g/mol
LogP2.19
Rot. Bonds2

About 1-(3H-inden-1-yl)-N,N-dimethylmethanamine

1-(3H-inden-1-yl)-N,N-dimethylmethanamine (PubChem CID 20658444) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 1-(3H-inden-1-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(3H-inden-1-yl)-N,N-dimethylmethanamine
PubChem CID20658444
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name1-(3H-inden-1-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1=CCc2ccccc21
InChIInChI=1S/C12H15N/c1-13(2)9-11-8-7-10-5-3-4-6-12(10)11/h3-6,8H,7,9H2,1-2H3
InChIKeySSLHXZSPWIDYRF-UHFFFAOYSA-N
XLogP2.19
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(chloromethyl)-1H-indene
CID 55301076
1-(3H-inden-1-yl)-N-methylmethanamine
CID 105431281
2-(3H-inden-1-yl)-N-methylethanamine
CID 58164560
3-(2-bromopropyl)-1H-indene
CID 23559641
N-acetyl-N-(3H-inden-1-ylmethyl)prop-2-enamide
CID 163287223
dichlorozirconium;3-propyl-1H-indene
CID 175084745
acetic acid;3H-inden-1-ylmethanol
CID 71363289
3-(2-azidoethyl)-1H-indene
CID 151053192
3H-inden-1-ylmethyl(diphenyl)phosphane
CID 102218742
3-but-3-enyl-1H-indene
CID 15878391
3-(2-cyclopropylethyl)-1H-indene
CID 163857034
3-[(2S,5S)-6-fluoro-2,5-dimethylhexyl]-1H-indene
CID 157089800

Frequently Asked Questions

What is the IUPAC name of 1-(3H-inden-1-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(3H-inden-1-yl)-N,N-dimethylmethanamine (CID 20658444) is 1-(3H-inden-1-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(3H-inden-1-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(3H-inden-1-yl)-N,N-dimethylmethanamine is CN(C)CC1=CCc2ccccc21.
What is the InChIKey of 1-(3H-inden-1-yl)-N,N-dimethylmethanamine?
The InChIKey is SSLHXZSPWIDYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-13(2)9-11-8-7-10-5-3-4-6-12(10)11/h3-6,8H,7,9H2,1-2H3.
What are the key properties of 1-(3H-inden-1-yl)-N,N-dimethylmethanamine?
1-(3H-inden-1-yl)-N,N-dimethylmethanamine has a molecular weight of 173.26 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3H-inden-1-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 20658444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).