N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine

C15H23N — CID 125481800

IUPACN-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine
SMILESCCCN(C)C[C@@H]1Cc2ccccc2[C@H]1C
InChIInChI=1S/C15H23N/c1-4-9-16(3)11-14-10-13-7-5-6-8-15(13)12(14)2/h5-8,12,14H,4,9-11H2,1-3H3/t12-,14-/m0/s1
InChIKeyORJLUTYZROFIBO-JSGCOSHPSA-N
MW217.36 g/mol
LogP3.30
Rot. Bonds4

About N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine

N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine (PubChem CID 125481800) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine
PubChem CID125481800
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine
SMILESCCCN(C)C[C@@H]1Cc2ccccc2[C@H]1C
InChIInChI=1S/C15H23N/c1-4-9-16(3)11-14-10-13-7-5-6-8-15(13)12(14)2/h5-8,12,14H,4,9-11H2,1-3H3/t12-,14-/m0/s1
InChIKeyORJLUTYZROFIBO-JSGCOSHPSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine with MolForge

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Related Compounds

N-methyl-N-[[(1S,2S)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]butan-1-amine
CID 125481673
N-[[(1R,2S)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine
CID 124705292
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-N-methyloctan-1-amine
CID 23382324
(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 130469930
N-methyl-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)propan-1-amine
CID 65262509
(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-amine;hydrochloride
CID 122155821
(1S)-1-methyl-2,3-dihydro-1H-inden-2-ol
CID 89059414
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-N-(2-chloroethyl)propan-1-amine
CID 66394694
(2S)-1-methyl-2-pentan-3-yl-2,3-dihydro-1H-indene
CID 163961847
(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-indene;ethane;methane
CID 157409915
(1R)-1-propyl-2,3-dihydro-1H-inden-2-amine
CID 143271430
3-(1,3-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-N,N-diethyl-1,2-oxazol-4-amine
CID 139770773

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine?
The IUPAC name of N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine (CID 125481800) is N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine.
What is the SMILES notation for N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine?
The canonical SMILES for N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine is CCCN(C)C[C@@H]1Cc2ccccc2[C@H]1C.
What is the InChIKey of N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine?
The InChIKey is ORJLUTYZROFIBO-JSGCOSHPSA-N. The full InChI is InChI=1S/C15H23N/c1-4-9-16(3)11-14-10-13-7-5-6-8-15(13)12(14)2/h5-8,12,14H,4,9-11H2,1-3H3/t12-,14-/m0/s1.
What are the key properties of N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine?
N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 125481800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).