N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine

C18H24N2O — CID 62291505

IUPACN-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cc(OCC2CC2)nc2ccccc12
InChIInChI=1S/C18H24N2O/c1-18(2,3)19-11-14-10-17(21-12-13-8-9-13)20-16-7-5-4-6-15(14)16/h4-7,10,13,19H,8-9,11-12H2,1-3H3
InChIKeyGTPIYQBYTVPHFC-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.91
Rot. Bonds5

About N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine

N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine (PubChem CID 62291505) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine
PubChem CID62291505
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cc(OCC2CC2)nc2ccccc12
InChIInChI=1S/C18H24N2O/c1-18(2,3)19-11-14-10-17(21-12-13-8-9-13)20-16-7-5-4-6-15(14)16/h4-7,10,13,19H,8-9,11-12H2,1-3H3
InChIKeyGTPIYQBYTVPHFC-UHFFFAOYSA-N
XLogP3.91
TPSA34.15 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 ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine (CID 62291505) is N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1cc(OCC2CC2)nc2ccccc12.
What is the InChIKey of N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is GTPIYQBYTVPHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-18(2,3)19-11-14-10-17(21-12-13-8-9-13)20-16-7-5-4-6-15(14)16/h4-7,10,13,19H,8-9,11-12H2,1-3H3.
What are the key properties of N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine?
N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 284.40 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(cyclopropylmethoxy)quinolin-4-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62291505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).