N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

C16H18N2O — CID 106473014

IUPACN-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCc1ccc2nc3c(c(NC4CC4)c2c1)COCC3
InChIInChI=1S/C16H18N2O/c1-10-2-5-14-12(8-10)16(17-11-3-4-11)13-9-19-7-6-15(13)18-14/h2,5,8,11H,3-4,6-7,9H2,1H3,(H,17,18)
InChIKeyNRIVYBSCRFDYKA-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.19
Rot. Bonds2

About N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (PubChem CID 106473014) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.

Molecular Properties

Compound NameN-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
PubChem CID106473014
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCc1ccc2nc3c(c(NC4CC4)c2c1)COCC3
InChIInChI=1S/C16H18N2O/c1-10-2-5-14-12(8-10)16(17-11-3-4-11)13-9-19-7-6-15(13)18-14/h2,5,8,11H,3-4,6-7,9H2,1H3,(H,17,18)
InChIKeyNRIVYBSCRFDYKA-UHFFFAOYSA-N
XLogP3.19
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The IUPAC name of N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (CID 106473014) is N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.
What is the SMILES notation for N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The canonical SMILES for N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is Cc1ccc2nc3c(c(NC4CC4)c2c1)COCC3.
What is the InChIKey of N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The InChIKey is NRIVYBSCRFDYKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-10-2-5-14-12(8-10)16(17-11-3-4-11)13-9-19-7-6-15(13)18-14/h2,5,8,11H,3-4,6-7,9H2,1H3,(H,17,18).
What are the key properties of N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine has a molecular weight of 254.33 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is sourced from PubChem (CID 106473014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).