(1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine

C15H21NO — CID 95164534

IUPAC(1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine
SMILESCOCCN(C1CC1)[C@H]1CCc2ccccc21
InChIInChI=1S/C15H21NO/c1-17-11-10-16(13-7-8-13)15-9-6-12-4-2-3-5-14(12)15/h2-5,13,15H,6-11H2,1H3/t15-/m0/s1
InChIKeyCISXSLUNHZQBTO-HNNXBMFYSA-N
MW231.34 g/mol
LogP2.78
Rot. Bonds5

About (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine

(1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 95164534) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID95164534
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name(1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine
SMILESCOCCN(C1CC1)[C@H]1CCc2ccccc21
InChIInChI=1S/C15H21NO/c1-17-11-10-16(13-7-8-13)15-9-6-12-4-2-3-5-14(12)15/h2-5,13,15H,6-11H2,1H3/t15-/m0/s1
InChIKeyCISXSLUNHZQBTO-HNNXBMFYSA-N
XLogP2.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine (CID 95164534) is (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine is COCCN(C1CC1)[C@H]1CCc2ccccc21.
What is the InChIKey of (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is CISXSLUNHZQBTO-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H21NO/c1-17-11-10-16(13-7-8-13)15-9-6-12-4-2-3-5-14(12)15/h2-5,13,15H,6-11H2,1H3/t15-/m0/s1.
What are the key properties of (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine?
(1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 231.34 g/mol, XLogP of 2.78, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 95164534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).