N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine

C16H24N2O2 — CID 43775844

IUPACN-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine
SMILESCOc1ccc2c(c1)C(NC1CCN(C)CC1)CCO2
InChIInChI=1S/C16H24N2O2/c1-18-8-5-12(6-9-18)17-15-7-10-20-16-4-3-13(19-2)11-14(15)16/h3-4,11-12,15,17H,5-10H2,1-2H3
InChIKeyKMZWFUHTVUWYEJ-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.20
Rot. Bonds3

About N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine

N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine (PubChem CID 43775844) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine
PubChem CID43775844
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine
SMILESCOc1ccc2c(c1)C(NC1CCN(C)CC1)CCO2
InChIInChI=1S/C16H24N2O2/c1-18-8-5-12(6-9-18)17-15-7-10-20-16-4-3-13(19-2)11-14(15)16/h3-4,11-12,15,17H,5-10H2,1-2H3
InChIKeyKMZWFUHTVUWYEJ-UHFFFAOYSA-N
XLogP2.20
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methoxy-N-(oxan-4-yl)-3,4-dihydro-2H-chromen-4-amine
CID 75422627
6-methoxy-N-[(2-methylpropan-2-yl)oxy]-3,4-dihydro-2H-chromen-4-amine
CID 82720276
6-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-chromen-4-amine
CID 43756306
4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine
CID 178102409
N-(2,5-dibromophenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 43789312
(2R)-1-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]propan-2-ol
CID 113349398
6-methoxy-N-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-4-amine
CID 103522678
N-benzyl-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 12851988
6-methoxy-4-propan-2-yl-3,4-dihydro-2H-chromene
CID 155736305
(7-methoxy-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)hydrazine
CID 82241529
N-(2-chlorophenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 43763115
6-methoxy-N-(thian-4-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
CID 115720011

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine?
The IUPAC name of N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine (CID 43775844) is N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine.
What is the SMILES notation for N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine?
The canonical SMILES for N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine is COc1ccc2c(c1)C(NC1CCN(C)CC1)CCO2.
What is the InChIKey of N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine?
The InChIKey is KMZWFUHTVUWYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-18-8-5-12(6-9-18)17-15-7-10-20-16-4-3-13(19-2)11-14(15)16/h3-4,11-12,15,17H,5-10H2,1-2H3.
What are the key properties of N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine?
N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine has a molecular weight of 276.38 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine is sourced from PubChem (CID 43775844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).