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

C18H22N2 — CID 95126700

IUPACN-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine
SMILESC[C@@H](Cc1ccccn1)N(C)C1Cc2ccccc2C1
InChIInChI=1S/C18H22N2/c1-14(11-17-9-5-6-10-19-17)20(2)18-12-15-7-3-4-8-16(15)13-18/h3-10,14,18H,11-13H2,1-2H3/t14-/m0/s1
InChIKeyPLGDCVKNZAHKTK-AWEZNQCLSA-N
MW266.39 g/mol
LogP3.11
Rot. Bonds4

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

N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 95126700) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine
PubChem CID95126700
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC NameN-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine
SMILESC[C@@H](Cc1ccccn1)N(C)C1Cc2ccccc2C1
InChIInChI=1S/C18H22N2/c1-14(11-17-9-5-6-10-19-17)20(2)18-12-15-7-3-4-8-16(15)13-18/h3-10,14,18H,11-13H2,1-2H3/t14-/m0/s1
InChIKeyPLGDCVKNZAHKTK-AWEZNQCLSA-N
XLogP3.11
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-methyl-N-(2-pyridin-2-ylethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 26458421
2-(2-cyclopropyl-3-methylbutyl)pyridine
CID 54206046
2-N-cyclopropyl-2-N-methyl-1-N-(2-pyridin-2-ylethyl)propane-1,2-diamine
CID 114133382
3-cyclopropyl-1-pyridin-2-ylbutan-2-amine
CID 83155129
2-(2-bromo-3-cyclopropylbutyl)pyridine
CID 83152951
(3R)-3-[2,3-dihydro-1H-inden-2-yl(methyl)amino]-N-methylbutanamide
CID 95147060
(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
1-cyclohexyl-N-methyl-2-pyridin-2-ylethanamine
CID 60819908
1-cyclopropyl-N-methyl-2-pyridin-2-ylethanamine
CID 63352689
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
1-(1-amino-2-pyridin-2-ylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 79074427

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine (CID 95126700) is N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine is C[C@@H](Cc1ccccn1)N(C)C1Cc2ccccc2C1.
What is the InChIKey of N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is PLGDCVKNZAHKTK-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H22N2/c1-14(11-17-9-5-6-10-19-17)20(2)18-12-15-7-3-4-8-16(15)13-18/h3-10,14,18H,11-13H2,1-2H3/t14-/m0/s1.
What are the key properties of N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine?
N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 266.39 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 95126700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).