[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine

C17H26N2 — CID 43809104

IUPAC[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
SMILESCCC1CCCN(C2(CN)Cc3ccccc3C2)C1
InChIInChI=1S/C17H26N2/c1-2-14-6-5-9-19(12-14)17(13-18)10-15-7-3-4-8-16(15)11-17/h3-4,7-8,14H,2,5-6,9-13,18H2,1H3
InChIKeyHQIMVBHMSOGZRN-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.60
Rot. Bonds3

About [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine

[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine (PubChem CID 43809104) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine.

Molecular Properties

Compound Name[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
PubChem CID43809104
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
SMILESCCC1CCCN(C2(CN)Cc3ccccc3C2)C1
InChIInChI=1S/C17H26N2/c1-2-14-6-5-9-19(12-14)17(13-18)10-15-7-3-4-8-16(15)11-17/h3-4,7-8,14H,2,5-6,9-13,18H2,1H3
InChIKeyHQIMVBHMSOGZRN-UHFFFAOYSA-N
XLogP2.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(3-methylpiperidin-1-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine
CID 60796225
[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine
CID 43584374
[4-tert-butyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 43584372
[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 64625427
[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-ethylcycloheptyl]methanamine
CID 65087911
[2-(azepan-1-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine
CID 54918791
[2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
CID 63156873
[2-(2,2-dimethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine
CID 43809107
1-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]-N,N-dimethylpiperidin-4-amine
CID 60797130
[2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine
CID 43809109
[2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-1,3-dihydroinden-2-yl]methanamine
CID 82752059
[1-(3-ethylpyrrolidin-1-yl)-3-methoxycyclohexyl]methanamine
CID 106872732

Frequently Asked Questions

What is the IUPAC name of [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
The IUPAC name of [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine (CID 43809104) is [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine.
What is the SMILES notation for [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
The canonical SMILES for [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine is CCC1CCCN(C2(CN)Cc3ccccc3C2)C1.
What is the InChIKey of [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
The InChIKey is HQIMVBHMSOGZRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-2-14-6-5-9-19(12-14)17(13-18)10-15-7-3-4-8-16(15)11-17/h3-4,7-8,14H,2,5-6,9-13,18H2,1H3.
What are the key properties of [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine has a molecular weight of 258.41 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine is sourced from PubChem (CID 43809104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).