N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine

C18H25N3 — CID 81428007

IUPACN-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine
SMILESCCCNC1CCN(CCc2cccc3cccnc23)C1
InChIInChI=1S/C18H25N3/c1-2-10-19-17-9-13-21(14-17)12-8-16-6-3-5-15-7-4-11-20-18(15)16/h3-7,11,17,19H,2,8-10,12-14H2,1H3
InChIKeyMLFGEURAGYFXIX-UHFFFAOYSA-N
MW283.42 g/mol
LogP2.85
Rot. Bonds6

About N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine

N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine (PubChem CID 81428007) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine
PubChem CID81428007
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine
SMILESCCCNC1CCN(CCc2cccc3cccnc23)C1
InChIInChI=1S/C18H25N3/c1-2-10-19-17-9-13-21(14-17)12-8-16-6-3-5-15-7-4-11-20-18(15)16/h3-7,11,17,19H,2,8-10,12-14H2,1H3
InChIKeyMLFGEURAGYFXIX-UHFFFAOYSA-N
XLogP2.85
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine
CID 81427742
1-ethyl-N-(2-quinolin-8-ylethyl)piperidin-4-amine
CID 81297387
[1-(2-quinolin-8-ylethyl)pyrrolidin-3-yl]methanamine
CID 81427571
1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 43315228
N-propyl-1-(pyridin-2-ylmethyl)pyrrolidin-3-amine
CID 60860967
(3R,4R)-1,4-dimethyl-N-(2-quinolin-8-ylethyl)pyrrolidin-3-amine
CID 97223040
tert-butyl 3-(2-quinolin-8-ylethylamino)azetidine-1-carboxylate
CID 113263719
N-(2-quinolin-8-ylethyl)thian-4-amine
CID 112727581
1-ethyl-2-(2-quinolin-8-ylethyl)-3-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]guanidine
CID 111914116
1-prop-2-ynyl-N-(quinolin-8-ylmethyl)piperidin-4-amine
CID 81333275
2-(4-methylpiperidin-1-yl)-N-(quinolin-8-ylmethyl)ethanamine
CID 61239909
1-(naphthalen-1-ylmethyl)-N-propylpiperidin-4-amine
CID 60820486

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine?
The IUPAC name of N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine (CID 81428007) is N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine.
What is the SMILES notation for N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine?
The canonical SMILES for N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine is CCCNC1CCN(CCc2cccc3cccnc23)C1.
What is the InChIKey of N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine?
The InChIKey is MLFGEURAGYFXIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-2-10-19-17-9-13-21(14-17)12-8-16-6-3-5-15-7-4-11-20-18(15)16/h3-7,11,17,19H,2,8-10,12-14H2,1H3.
What are the key properties of N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine?
N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine has a molecular weight of 283.42 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine is sourced from PubChem (CID 81428007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).