N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine

C17H24N2O — CID 162388983

IUPACN,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine
SMILESCC(C)Oc1ccc2c(ccn2CC2(N(C)C)CC2)c1
InChIInChI=1S/C17H24N2O/c1-13(2)20-15-5-6-16-14(11-15)7-10-19(16)12-17(8-9-17)18(3)4/h5-7,10-11,13H,8-9,12H2,1-4H3
InChIKeyJMAKDDMBSIIHCV-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.52
Rot. Bonds5

About N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine

N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine (PubChem CID 162388983) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine
PubChem CID162388983
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine
SMILESCC(C)Oc1ccc2c(ccn2CC2(N(C)C)CC2)c1
InChIInChI=1S/C17H24N2O/c1-13(2)20-15-5-6-16-14(11-15)7-10-19(16)12-17(8-9-17)18(3)4/h5-7,10-11,13H,8-9,12H2,1-4H3
InChIKeyJMAKDDMBSIIHCV-UHFFFAOYSA-N
XLogP3.52
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine?
The IUPAC name of N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine (CID 162388983) is N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine is CC(C)Oc1ccc2c(ccn2CC2(N(C)C)CC2)c1.
What is the InChIKey of N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine?
The InChIKey is JMAKDDMBSIIHCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-13(2)20-15-5-6-16-14(11-15)7-10-19(16)12-17(8-9-17)18(3)4/h5-7,10-11,13H,8-9,12H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine?
N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine has a molecular weight of 272.39 g/mol, XLogP of 3.52, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 162388983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).