2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol

C14H22N2O — CID 64790575

IUPAC2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol
SMILESCNC(CO)CCN1c2ccccc2CC1C
InChIInChI=1S/C14H22N2O/c1-11-9-12-5-3-4-6-14(12)16(11)8-7-13(10-17)15-2/h3-6,11,13,15,17H,7-10H2,1-2H3
InChIKeyCWQLUPXXUAOLEB-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.41
Rot. Bonds5

About 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol

2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol (PubChem CID 64790575) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol.

Molecular Properties

Compound Name2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol
PubChem CID64790575
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol
SMILESCNC(CO)CCN1c2ccccc2CC1C
InChIInChI=1S/C14H22N2O/c1-11-9-12-5-3-4-6-14(12)16(11)8-7-13(10-17)15-2/h3-6,11,13,15,17H,7-10H2,1-2H3
InChIKeyCWQLUPXXUAOLEB-UHFFFAOYSA-N
XLogP1.41
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,3-diethoxypropyl)-2-methyl-2,3-dihydroindole
CID 63628082
3-(2-methyl-2,3-dihydroindol-1-yl)-1-(2-methylphenyl)propan-1-ol
CID 62623099
1-cyclohexyl-N-methyl-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 104744469
2-(methylamino)-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)butan-1-ol
CID 64810854
N-(cyclopropylmethyl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 60866414
4-(2-methyl-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 62424967
1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-ol
CID 62044766
1-(3-hydroxybutyl)-3-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]urea
CID 111337321
1-(4-bromobutyl)-2-methyl-2,3-dihydroindole
CID 61286704
4-(2-methyl-2,3-dihydroindol-1-yl)butanamide
CID 82040812
N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]pyrrolidine-1-carboxamide
CID 155947049
2-(methylamino)-4-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)butanoic acid
CID 63028897

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol?
The IUPAC name of 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol (CID 64790575) is 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol.
What is the SMILES notation for 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol?
The canonical SMILES for 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol is CNC(CO)CCN1c2ccccc2CC1C.
What is the InChIKey of 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol?
The InChIKey is CWQLUPXXUAOLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-9-12-5-3-4-6-14(12)16(11)8-7-13(10-17)15-2/h3-6,11,13,15,17H,7-10H2,1-2H3.
What are the key properties of 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol?
2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-4-(2-methyl-2,3-dihydroindol-1-yl)butan-1-ol is sourced from PubChem (CID 64790575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).