N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine

C18H20N2O — CID 60716310

IUPACN-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine
SMILESCc1cc(NC(C)CCc2ccco2)c2ccccc2n1
InChIInChI=1S/C18H20N2O/c1-13(9-10-15-6-5-11-21-15)19-18-12-14(2)20-17-8-4-3-7-16(17)18/h3-8,11-13H,9-10H2,1-2H3,(H,19,20)
InChIKeyDMPBRKSTQRAMGA-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.57
Rot. Bonds5

About N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine

N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine (PubChem CID 60716310) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine.

Molecular Properties

Compound NameN-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine
PubChem CID60716310
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine
SMILESCc1cc(NC(C)CCc2ccco2)c2ccccc2n1
InChIInChI=1S/C18H20N2O/c1-13(9-10-15-6-5-11-21-15)19-18-12-14(2)20-17-8-4-3-7-16(17)18/h3-8,11-13H,9-10H2,1-2H3,(H,19,20)
InChIKeyDMPBRKSTQRAMGA-UHFFFAOYSA-N
XLogP4.57
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(furan-2-yl)butan-2-yl]acridin-9-amine
CID 4516381
2-methyl-N-(5-methylhexan-2-yl)quinolin-4-amine
CID 63926717
2-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]-3H-quinazolin-4-one
CID 136747972
2-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]ethanamine
CID 78942785
2-[4-(furan-2-yl)butan-2-ylamino]-6-methylpyrimidine-4-carboxylic acid
CID 107553533
[2-[4-(furan-2-yl)butan-2-ylamino]phenyl]methanol
CID 43743342
N-[4-(furan-2-yl)butan-2-yl]quinoxalin-2-amine
CID 60716487
N-[4-(furan-2-yl)butan-2-yl]-1,3-benzoxazol-2-amine
CID 60715726
2-methyl-N-(1-thiophen-2-ylpropan-2-yl)quinolin-4-amine
CID 63540902
1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
CID 78943029
2-[4-(furan-2-yl)butan-2-ylamino]-7-methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
CID 47018684
2-[4-(furan-2-yl)butan-2-ylamino]-5-methylbenzoic acid
CID 62516226

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine?
The IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine (CID 60716310) is N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine.
What is the SMILES notation for N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine?
The canonical SMILES for N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine is Cc1cc(NC(C)CCc2ccco2)c2ccccc2n1.
What is the InChIKey of N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine?
The InChIKey is DMPBRKSTQRAMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-13(9-10-15-6-5-11-21-15)19-18-12-14(2)20-17-8-4-3-7-16(17)18/h3-8,11-13H,9-10H2,1-2H3,(H,19,20).
What are the key properties of N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine?
N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine has a molecular weight of 280.37 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine is sourced from PubChem (CID 60716310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).