(2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine

C15H22N2 — CID 160583702

IUPAC(2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine
SMILESCC[C@H](Cn1ccc2cc(C)ccc21)N(C)C
InChIInChI=1S/C15H22N2/c1-5-14(16(3)4)11-17-9-8-13-10-12(2)6-7-15(13)17/h6-10,14H,5,11H2,1-4H3/t14-/m1/s1
InChIKeyYEYIPNFPUSKIFW-CQSZACIVSA-N
MW230.35 g/mol
LogP3.29
Rot. Bonds4

About (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine

(2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine (PubChem CID 160583702) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine.

Molecular Properties

Compound Name(2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine
PubChem CID160583702
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name(2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine
SMILESCC[C@H](Cn1ccc2cc(C)ccc21)N(C)C
InChIInChI=1S/C15H22N2/c1-5-14(16(3)4)11-17-9-8-13-10-12(2)6-7-15(13)17/h6-10,14H,5,11H2,1-4H3/t14-/m1/s1
InChIKeyYEYIPNFPUSKIFW-CQSZACIVSA-N
XLogP3.29
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,2-dimethylpropyl)-5-methylindole
CID 90966063
N-[2-(5-methylindol-1-yl)ethyl]butan-2-amine
CID 63556189
1-(methoxymethyl)-5-methylindole
CID 110831319
2-(5-methylindol-1-yl)acetaldehyde
CID 63554780
2-(5-methylindol-1-yl)ethanamine;hydrochloride
CID 91640635
1-(2-methoxyethyl)-5-methylindole
CID 116622979
N,N-dimethyl-1-(2-methylpropyl)indol-5-amine
CID 140929126
2-methyl-N-[2-(5-methylindol-1-yl)ethyl]propan-1-amine
CID 63556206
N-ethyl-2-(5-methylindol-1-yl)acetamide
CID 116623028
1-indol-1-yl-N,N-dimethylpropan-2-amine
CID 154694251
1-(2,2-difluoroethyl)-6-methylindole
CID 116546869
5-methyl-1-(oxiran-2-ylmethyl)indole
CID 54857157

Frequently Asked Questions

What is the IUPAC name of (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine?
The IUPAC name of (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine (CID 160583702) is (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine.
What is the SMILES notation for (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine?
The canonical SMILES for (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine is CC[C@H](Cn1ccc2cc(C)ccc21)N(C)C.
What is the InChIKey of (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine?
The InChIKey is YEYIPNFPUSKIFW-CQSZACIVSA-N. The full InChI is InChI=1S/C15H22N2/c1-5-14(16(3)4)11-17-9-8-13-10-12(2)6-7-15(13)17/h6-10,14H,5,11H2,1-4H3/t14-/m1/s1.
What are the key properties of (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine?
(2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine has a molecular weight of 230.35 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N-dimethyl-1-(5-methylindol-1-yl)butan-2-amine is sourced from PubChem (CID 160583702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).