N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine

C13H20N2 — CID 80567683

IUPACN-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine
SMILESCC(C)N(C)CC1Cc2ccccc2N1
InChIInChI=1S/C13H20N2/c1-10(2)15(3)9-12-8-11-6-4-5-7-13(11)14-12/h4-7,10,12,14H,8-9H2,1-3H3
InChIKeyZRERYQHSHZSPKG-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.36
Rot. Bonds3

About N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine

N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine (PubChem CID 80567683) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine
PubChem CID80567683
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine
SMILESCC(C)N(C)CC1Cc2ccccc2N1
InChIInChI=1S/C13H20N2/c1-10(2)15(3)9-12-8-11-6-4-5-7-13(11)14-12/h4-7,10,12,14H,8-9H2,1-3H3
InChIKeyZRERYQHSHZSPKG-UHFFFAOYSA-N
XLogP2.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydro-1H-indol-2-ylmethyl)-2-methoxy-N-methylethanamine
CID 80567671
N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methyl-2-phenylethanamine
CID 80567527
N-[[(2S)-2,3-dihydro-1H-indol-2-yl]methyl]-N,2-dimethylbutan-2-amine
CID 112736749
N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-(2-methylpropyl)cyclopentanamine
CID 80568085
2-(propan-2-ylsulfonylmethyl)-2,3-dihydro-1H-indole
CID 115104067
N-methyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)propan-2-amine
CID 106901949
N-[(4-bromophenyl)methyl]-1-(2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine
CID 80567476
N-butan-2-yl-N-(2,3-dihydro-1H-indol-2-ylmethyl)butan-1-amine
CID 80567596
2-(2-methylbutyl)-2,3-dihydro-1H-indole
CID 65042120
N-[[(2S)-2,3-dihydro-1H-indol-2-yl]methyl]propan-2-amine
CID 130522123
N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-ethylaniline
CID 80567470
[(2S)-2,3-dihydro-1H-indol-2-yl]methanamine
CID 82667971

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine (CID 80567683) is N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine is CC(C)N(C)CC1Cc2ccccc2N1.
What is the InChIKey of N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine?
The InChIKey is ZRERYQHSHZSPKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-10(2)15(3)9-12-8-11-6-4-5-7-13(11)14-12/h4-7,10,12,14H,8-9H2,1-3H3.
What are the key properties of N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine?
N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine has a molecular weight of 204.32 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methylpropan-2-amine is sourced from PubChem (CID 80567683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).