1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine

C15H22N2O — CID 22573243

IUPAC1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine
SMILESNC1CCN(CC2CCc3ccccc3O2)CC1
InChIInChI=1S/C15H22N2O/c16-13-7-9-17(10-8-13)11-14-6-5-12-3-1-2-4-15(12)18-14/h1-4,13-14H,5-11,16H2
InChIKeySRONEZRNNDWTDS-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.80
Rot. Bonds2

About 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine

1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine (PubChem CID 22573243) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine
PubChem CID22573243
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine
SMILESNC1CCN(CC2CCc3ccccc3O2)CC1
InChIInChI=1S/C15H22N2O/c16-13-7-9-17(10-8-13)11-14-6-5-12-3-1-2-4-15(12)18-14/h1-4,13-14H,5-11,16H2
InChIKeySRONEZRNNDWTDS-UHFFFAOYSA-N
XLogP1.80
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-benzyl-1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidine
CID 11220953
[1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-yl]carbamic acid
CID 22573238
4-[[(2R)-3,4-dihydro-2H-chromen-2-yl]methyl]-1,2,4-triazole
CID 50965959
1-[[(4R)-2,3,4,5-tetrahydro-1-benzoxepin-4-yl]methyl]piperidin-4-amine
CID 97269079
1-[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-yl]-N-methylmethanamine
CID 66363591
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-one
CID 55052644
2-[(2S)-3,4-dihydro-2H-chromen-2-yl]ethanol
CID 54393265
2-(3,4-dihydro-2H-chromen-2-yl)acetaldehyde
CID 54477156
N-[[1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-yl]methyl]-6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-amine;dihydrobromide
CID 14049046
5-(1,2,4,5-tetrahydro-3-benzazepin-3-ylmethyl)oxolan-2-one
CID 157011867
(2R)-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3,4-dihydro-2H-chromen-7-ol
CID 10803828
1-[(6-benzyl-3,4-dihydro-2H-chromen-2-yl)methyl]pyrrolidine
CID 23553213

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine?
The IUPAC name of 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine (CID 22573243) is 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine is NC1CCN(CC2CCc3ccccc3O2)CC1.
What is the InChIKey of 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine?
The InChIKey is SRONEZRNNDWTDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c16-13-7-9-17(10-8-13)11-14-6-5-12-3-1-2-4-15(12)18-14/h1-4,13-14H,5-11,16H2.
What are the key properties of 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine?
1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine has a molecular weight of 246.35 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 22573243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).