N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine

C17H23N3 — CID 81427742

IUPACN-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine
SMILESCCCNC1CCN(Cc2cccc3cccnc23)C1
InChIInChI=1S/C17H23N3/c1-2-9-18-16-8-11-20(13-16)12-15-6-3-5-14-7-4-10-19-17(14)15/h3-7,10,16,18H,2,8-9,11-13H2,1H3
InChIKeyCNPGAZMPLUNDLH-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.81
Rot. Bonds5

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

N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine (PubChem CID 81427742) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine
PubChem CID81427742
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine
SMILESCCCNC1CCN(Cc2cccc3cccnc23)C1
InChIInChI=1S/C17H23N3/c1-2-9-18-16-8-11-20(13-16)12-15-6-3-5-14-7-4-10-19-17(14)15/h3-7,10,16,18H,2,8-9,11-13H2,1H3
InChIKeyCNPGAZMPLUNDLH-UHFFFAOYSA-N
XLogP2.81
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine
CID 81428007
1-ethyl-N-(2-quinolin-8-ylethyl)piperidin-4-amine
CID 81297387
N-propyl-1-(pyridin-2-ylmethyl)pyrrolidin-3-amine
CID 60860967
1-(naphthalen-1-ylmethyl)-N-propylpiperidin-4-amine
CID 60820486
N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine
CID 63854973
1-(quinolin-8-ylmethyl)pyrrolidine-3-carboxylic acid
CID 63031197
1-prop-2-ynyl-N-(quinolin-8-ylmethyl)piperidin-4-amine
CID 81333275
8-[(5-methyl-1,4-diazepan-1-yl)methyl]quinoline
CID 81423173
1-(quinolin-8-ylmethyl)piperidine-4-carbaldehyde
CID 62654466
8-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)quinoline
CID 78945122
1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanone
CID 63845455
3-(2-methylphenyl)-5-[(3S)-1-(quinolin-8-ylmethyl)pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 95830078

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine?
The IUPAC name of N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine (CID 81427742) is N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine.
What is the SMILES notation for N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine?
The canonical SMILES for N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine is CCCNC1CCN(Cc2cccc3cccnc23)C1.
What is the InChIKey of N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine?
The InChIKey is CNPGAZMPLUNDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-2-9-18-16-8-11-20(13-16)12-15-6-3-5-14-7-4-10-19-17(14)15/h3-7,10,16,18H,2,8-9,11-13H2,1H3.
What are the key properties of N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine?
N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine has a molecular weight of 269.39 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine is sourced from PubChem (CID 81427742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).