N-ethyl-3-quinolin-7-ylbutan-2-amine

C15H20N2 — CID 81224003

IUPACN-ethyl-3-quinolin-7-ylbutan-2-amine
SMILESCCNC(C)C(C)c1ccc2cccnc2c1
InChIInChI=1S/C15H20N2/c1-4-16-12(3)11(2)14-8-7-13-6-5-9-17-15(13)10-14/h5-12,16H,4H2,1-3H3
InChIKeyOJQUAJZSVWQCPE-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.34
Rot. Bonds4

About N-ethyl-3-quinolin-7-ylbutan-2-amine

N-ethyl-3-quinolin-7-ylbutan-2-amine (PubChem CID 81224003) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-ethyl-3-quinolin-7-ylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-quinolin-7-ylbutan-2-amine
PubChem CID81224003
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC NameN-ethyl-3-quinolin-7-ylbutan-2-amine
SMILESCCNC(C)C(C)c1ccc2cccnc2c1
InChIInChI=1S/C15H20N2/c1-4-16-12(3)11(2)14-8-7-13-6-5-9-17-15(13)10-14/h5-12,16H,4H2,1-3H3
InChIKeyOJQUAJZSVWQCPE-UHFFFAOYSA-N
XLogP3.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-quinolin-7-ylethanamine
CID 81221005
2-methyl-N-propan-2-yl-3-quinolin-7-ylbutan-1-amine
CID 81222762
N-ethyl-2-propan-2-ylsulfanyl-1-quinolin-7-ylethanamine
CID 81231123
2-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 81231185
N-ethyl-2-methylsulfonyl-1-quinolin-7-ylpropan-1-amine
CID 105021408
2-methyl-N-propyl-1-quinolin-7-ylpropan-1-amine
CID 81220696
3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 105172706
N-[(2-methylcyclopropyl)-quinolin-7-ylmethyl]ethanamine
CID 81231204
N-[(3-chlorophenyl)-quinolin-7-ylmethyl]ethanamine
CID 81210398
N-[(3-fluorophenyl)-quinolin-7-ylmethyl]ethanamine
CID 81210647
N-[(1-methylcyclopentyl)-quinolin-7-ylmethyl]ethanamine
CID 105021674
N-tert-butyl-2-methyl-3-quinolin-7-ylbutan-1-amine
CID 81223626

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-quinolin-7-ylbutan-2-amine?
The IUPAC name of N-ethyl-3-quinolin-7-ylbutan-2-amine (CID 81224003) is N-ethyl-3-quinolin-7-ylbutan-2-amine.
What is the SMILES notation for N-ethyl-3-quinolin-7-ylbutan-2-amine?
The canonical SMILES for N-ethyl-3-quinolin-7-ylbutan-2-amine is CCNC(C)C(C)c1ccc2cccnc2c1.
What is the InChIKey of N-ethyl-3-quinolin-7-ylbutan-2-amine?
The InChIKey is OJQUAJZSVWQCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-4-16-12(3)11(2)14-8-7-13-6-5-9-17-15(13)10-14/h5-12,16H,4H2,1-3H3.
What are the key properties of N-ethyl-3-quinolin-7-ylbutan-2-amine?
N-ethyl-3-quinolin-7-ylbutan-2-amine has a molecular weight of 228.34 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-quinolin-7-ylbutan-2-amine is sourced from PubChem (CID 81224003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).