N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine

C19H24N2 — CID 62135686

IUPACN-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine
SMILESCc1cc(N2CCc3ccccc32)ccc1CNC(C)C
InChIInChI=1S/C19H24N2/c1-14(2)20-13-17-8-9-18(12-15(17)3)21-11-10-16-6-4-5-7-19(16)21/h4-9,12,14,20H,10-11,13H2,1-3H3
InChIKeyXSXHOWWTBIDVFK-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.19
Rot. Bonds4

About N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine

N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine (PubChem CID 62135686) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine
PubChem CID62135686
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine
SMILESCc1cc(N2CCc3ccccc32)ccc1CNC(C)C
InChIInChI=1S/C19H24N2/c1-14(2)20-13-17-8-9-18(12-15(17)3)21-11-10-16-6-4-5-7-19(16)21/h4-9,12,14,20H,10-11,13H2,1-3H3
InChIKeyXSXHOWWTBIDVFK-UHFFFAOYSA-N
XLogP4.19
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(3,4-dihydro-2H-quinolin-1-yl)-2-methylphenyl]-N-methylmethanamine
CID 62134837
N-[[4-(2,3-dihydroindol-1-yl)-6-methyl-3-pyridinyl]methyl]propan-2-amine
CID 81249037
N-[[4-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 81248946
N-[[5-bromo-2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62280668
N-[[4-(2,3-dihydroindol-1-yl)-3-fluorophenyl]methyl]propan-2-amine
CID 43281003
N-[[2-(2,3-dihydroindol-1-yl)-3-fluoro-4-pyridinyl]methyl]propan-2-amine
CID 105388865
N-[[4-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-methylphenyl]methyl]propan-2-amine
CID 65319981
4-(3,4-dihydro-2H-quinolin-1-yl)-2-methylbenzoic acid
CID 62136292
1-(3,5-dimethylphenyl)-2,3-dihydroindole
CID 91512599
N-[[4-(4-ethylpiperidin-1-yl)-2-methylphenyl]methyl]propan-2-amine
CID 62134046
[1-[3-methyl-4-[(propan-2-ylamino)methyl]phenyl]piperidin-2-yl]methanol
CID 62134031
N-[[2-methyl-4-(3,4,5-trimethylpiperazin-1-yl)phenyl]methyl]propan-2-amine
CID 114538629

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine?
The IUPAC name of N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine (CID 62135686) is N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine?
The canonical SMILES for N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine is Cc1cc(N2CCc3ccccc32)ccc1CNC(C)C.
What is the InChIKey of N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine?
The InChIKey is XSXHOWWTBIDVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-14(2)20-13-17-8-9-18(12-15(17)3)21-11-10-16-6-4-5-7-19(16)21/h4-9,12,14,20H,10-11,13H2,1-3H3.
What are the key properties of N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine?
N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine has a molecular weight of 280.42 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2,3-dihydroindol-1-yl)-2-methylphenyl]methyl]propan-2-amine is sourced from PubChem (CID 62135686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).