N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine

C16H24N2O — CID 61170368

IUPACN-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine
SMILESCCN1CCCC(NC2CCOc3ccccc32)C1
InChIInChI=1S/C16H24N2O/c1-2-18-10-5-6-13(12-18)17-15-9-11-19-16-8-4-3-7-14(15)16/h3-4,7-8,13,15,17H,2,5-6,9-12H2,1H3
InChIKeyZGWHMWJDWXHJBW-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.58
Rot. Bonds3

About N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine

N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine (PubChem CID 61170368) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine
PubChem CID61170368
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine
SMILESCCN1CCCC(NC2CCOc3ccccc32)C1
InChIInChI=1S/C16H24N2O/c1-2-18-10-5-6-13(12-18)17-15-9-11-19-16-8-4-3-7-14(15)16/h3-4,7-8,13,15,17H,2,5-6,9-12H2,1H3
InChIKeyZGWHMWJDWXHJBW-UHFFFAOYSA-N
XLogP2.58
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-dimethyl-3H-1-benzofuran-3-yl)-1-ethylpiperidin-3-amine
CID 106701023
N-(oxepan-4-yl)-3,4-dihydro-2H-chromen-4-amine
CID 65081994
N-(4-chloro-9H-xanthen-9-yl)-1-ethylpiperidin-3-amine
CID 21482830
1-ethyl-N-(9H-xanthen-9-yl)pyrrolidin-3-amine
CID 21482885
N-(3,5-dimethylcyclohexyl)-3,4-dihydro-2H-chromen-4-amine
CID 64752350
N-(2,3-dihydro-1H-inden-2-yl)-3,4-dihydro-2H-chromen-4-amine
CID 43723878
N-(2,6-dimethylcyclohexyl)-3,4-dihydro-2H-chromen-4-amine
CID 43223515
N-(3,4-dihydro-2H-chromen-4-yl)-1-methylsulfonylpiperidin-4-amine
CID 43628795
N-(1,8-dimethyl-9H-xanthen-9-yl)-1-ethylpiperidin-3-amine
CID 21482821
N-(3-ethylsulfanylcyclopentyl)-3,4-dihydro-2H-chromen-4-amine
CID 103787277
N-(1-piperidin-1-ylpropan-2-yl)-3,4-dihydro-2H-chromen-4-amine
CID 43749078
1-butyl-N-(9H-xanthen-9-yl)piperidin-3-amine
CID 21482838

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine (CID 61170368) is N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine is CCN1CCCC(NC2CCOc3ccccc32)C1.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine?
The InChIKey is ZGWHMWJDWXHJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-18-10-5-6-13(12-18)17-15-9-11-19-16-8-4-3-7-14(15)16/h3-4,7-8,13,15,17H,2,5-6,9-12H2,1H3.
What are the key properties of N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine?
N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine has a molecular weight of 260.38 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-4-yl)-1-ethylpiperidin-3-amine is sourced from PubChem (CID 61170368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).