N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine

C17H24N2O — CID 63529541

IUPACN-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine
SMILESCCCOc1cccc2cc(C(C)C)c(NCC)nc12
InChIInChI=1S/C17H24N2O/c1-5-10-20-15-9-7-8-13-11-14(12(3)4)17(18-6-2)19-16(13)15/h7-9,11-12H,5-6,10H2,1-4H3,(H,18,19)
InChIKeyJKQUWLBVOHQRFP-UHFFFAOYSA-N
MW272.39 g/mol
LogP4.58
Rot. Bonds6

About N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine

N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine (PubChem CID 63529541) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine
PubChem CID63529541
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine
SMILESCCCOc1cccc2cc(C(C)C)c(NCC)nc12
InChIInChI=1S/C17H24N2O/c1-5-10-20-15-9-7-8-13-11-14(12(3)4)17(18-6-2)19-16(13)15/h7-9,11-12H,5-6,10H2,1-4H3,(H,18,19)
InChIKeyJKQUWLBVOHQRFP-UHFFFAOYSA-N
XLogP4.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,3-diethyl-8-propoxyquinolin-2-amine
CID 63529540
8-chloro-N-ethyl-3-propan-2-ylquinolin-2-amine
CID 63525062
N-ethyl-8-(methoxymethyl)-3-propan-2-ylquinolin-2-amine
CID 55175771
2-chloro-8-ethoxy-3-propan-2-ylquinoline
CID 63531227
7,8-dichloro-N-ethyl-3-propan-2-ylquinolin-2-amine
CID 63524899
N,2-diethyl-8-propoxyquinolin-4-amine
CID 63481576
N-methyl-3-propan-2-yl-8-propylquinolin-2-amine
CID 63524556
2-propan-2-yl-8-propoxyquinolin-4-amine
CID 62203402
3-tert-butyl-8-ethoxy-N-propylquinolin-2-amine
CID 63382523
N-ethyl-6,7,8-trifluoro-3-propan-2-ylquinolin-2-amine
CID 63231864
2-tert-butyl-N-ethyl-8-propoxyquinolin-4-amine
CID 63481575
8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine
CID 107629224

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine?
The IUPAC name of N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine (CID 63529541) is N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine.
What is the SMILES notation for N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine?
The canonical SMILES for N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine is CCCOc1cccc2cc(C(C)C)c(NCC)nc12.
What is the InChIKey of N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine?
The InChIKey is JKQUWLBVOHQRFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-5-10-20-15-9-7-8-13-11-14(12(3)4)17(18-6-2)19-16(13)15/h7-9,11-12H,5-6,10H2,1-4H3,(H,18,19).
What are the key properties of N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine?
N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine has a molecular weight of 272.39 g/mol, XLogP of 4.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-propan-2-yl-8-propoxyquinolin-2-amine is sourced from PubChem (CID 63529541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).