N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine

C18H24N2O — CID 104790380

IUPACN-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccoc1C)C1CCCc2cccnc21
InChIInChI=1S/C18H24N2O/c1-3-10-19-18(15-9-12-21-13(15)2)16-8-4-6-14-7-5-11-20-17(14)16/h5,7,9,11-12,16,18-19H,3-4,6,8,10H2,1-2H3
InChIKeyBEGOVRSFZFGUQE-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.14
Rot. Bonds5

About N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine

N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine (PubChem CID 104790380) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine
PubChem CID104790380
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccoc1C)C1CCCc2cccnc21
InChIInChI=1S/C18H24N2O/c1-3-10-19-18(15-9-12-21-13(15)2)16-8-4-6-14-7-5-11-20-17(14)16/h5,7,9,11-12,16,18-19H,3-4,6,8,10H2,1-2H3
InChIKeyBEGOVRSFZFGUQE-UHFFFAOYSA-N
XLogP4.14
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

N-[(5-chlorofuran-2-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine
CID 106692530
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2-methylfuran-3-yl)methyl]hydrazine
CID 105269106
N-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,5-dimethylfuran-3-yl)methyl]propan-1-amine
CID 105009683
N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748838
N-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(4-methyl-3-pyridinyl)methyl]propan-1-amine
CID 114878556
N-[(3-chloro-4-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]propan-1-amine
CID 105166117
1-(furan-3-yl)-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 79748617
2-ethoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79747758
3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748513
N-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(pyrimidin-5-yl)methyl]propan-1-amine
CID 102923634
N-[(3-chloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methyl]propan-1-amine
CID 103444802
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine?
The IUPAC name of N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine (CID 104790380) is N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine?
The canonical SMILES for N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine is CCCNC(c1ccoc1C)C1CCCc2cccnc21.
What is the InChIKey of N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine?
The InChIKey is BEGOVRSFZFGUQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-10-19-18(15-9-12-21-13(15)2)16-8-4-6-14-7-5-11-20-17(14)16/h5,7,9,11-12,16,18-19H,3-4,6,8,10H2,1-2H3.
What are the key properties of N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine?
N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine has a molecular weight of 284.40 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylfuran-3-yl)-(5,6,7,8-tetrahydroquinolin-8-yl)methyl]propan-1-amine is sourced from PubChem (CID 104790380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).