2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine

C16H24N2 — CID 63957179

IUPAC2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine
SMILESCCN(CC1CC1)C1(CN)Cc2ccccc2C1
InChIInChI=1S/C16H24N2/c1-2-18(11-13-7-8-13)16(12-17)9-14-5-3-4-6-15(14)10-16/h3-6,13H,2,7-12,17H2,1H3
InChIKeyGIDUWMKWKYLLJA-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.21
Rot. Bonds5

About 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine

2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine (PubChem CID 63957179) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine
PubChem CID63957179
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine
SMILESCCN(CC1CC1)C1(CN)Cc2ccccc2C1
InChIInChI=1S/C16H24N2/c1-2-18(11-13-7-8-13)16(12-17)9-14-5-3-4-6-15(14)10-16/h3-6,13H,2,7-12,17H2,1H3
InChIKeyGIDUWMKWKYLLJA-UHFFFAOYSA-N
XLogP2.21
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine?
The IUPAC name of 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine (CID 63957179) is 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine.
What is the SMILES notation for 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine?
The canonical SMILES for 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine is CCN(CC1CC1)C1(CN)Cc2ccccc2C1.
What is the InChIKey of 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine?
The InChIKey is GIDUWMKWKYLLJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-2-18(11-13-7-8-13)16(12-17)9-14-5-3-4-6-15(14)10-16/h3-6,13H,2,7-12,17H2,1H3.
What are the key properties of 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine?
2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine has a molecular weight of 244.38 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1,3-dihydroinden-2-amine is sourced from PubChem (CID 63957179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).