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

C18H23N3 — CID 62286320

IUPACN-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1cc(N2c3ccccc3CC2C)ccn1
InChIInChI=1S/C18H23N3/c1-13(2)20-12-16-11-17(8-9-19-16)21-14(3)10-15-6-4-5-7-18(15)21/h4-9,11,13-14,20H,10,12H2,1-3H3
InChIKeyHCUMQLWKVDECPR-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.66
Rot. Bonds4

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

N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 62286320) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine
PubChem CID62286320
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1cc(N2c3ccccc3CC2C)ccn1
InChIInChI=1S/C18H23N3/c1-13(2)20-12-16-11-17(8-9-19-16)21-14(3)10-15-6-4-5-7-18(15)21/h4-9,11,13-14,20H,10,12H2,1-3H3
InChIKeyHCUMQLWKVDECPR-UHFFFAOYSA-N
XLogP3.66
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(chloromethyl)-4-pyridinyl]-2-methyl-2,3-dihydroindole
CID 61254888
[4-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]methanol
CID 61254539
N-[[4-(azocan-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62281231
4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide
CID 109210024
N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109209427
4-(2-methyl-2,3-dihydroindol-1-yl)-N-prop-2-enylpyridine-2-carboxamide
CID 109202250
N-[[4-(2-azabicyclo[2.2.1]heptan-2-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62294664
N-[[4-(2-methylmorpholin-4-yl)-2-pyridinyl]methyl]propan-2-amine
CID 55054705
N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109214008
2-(2-methyl-2,3-dihydroindol-1-yl)-N-propan-2-ylpropan-1-amine
CID 62425147
3,4-dihydro-1H-isoquinolin-2-yl-[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methanone
CID 109213833
N-[[4-(2-methyl-2,3-dihydroindole-1-carbonyl)-2-pyridinyl]methyl]acetamide
CID 112532256

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine (CID 62286320) is N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine is CC(C)NCc1cc(N2c3ccccc3CC2C)ccn1.
What is the InChIKey of N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is HCUMQLWKVDECPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-13(2)20-12-16-11-17(8-9-19-16)21-14(3)10-15-6-4-5-7-18(15)21/h4-9,11,13-14,20H,10,12H2,1-3H3.
What are the key properties of N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine?
N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 281.40 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 62286320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).