7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline

C14H15ClN2 — CID 20977046

IUPAC7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline
SMILESCC1(c2ccnc3cc(Cl)ccc23)CCCN1
InChIInChI=1S/C14H15ClN2/c1-14(6-2-7-17-14)12-5-8-16-13-9-10(15)3-4-11(12)13/h3-5,8-9,17H,2,6-7H2,1H3
InChIKeyJAXBCHBFBFCLBV-UHFFFAOYSA-N
MW246.74 g/mol
LogP3.49
Rot. Bonds1

About 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline

7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline (PubChem CID 20977046) has the molecular formula C14H15ClN2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline.

Molecular Properties

Compound Name7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline
PubChem CID20977046
Molecular FormulaC14H15ClN2
Molecular Weight246.74 g/mol
Exact Mass246.09
IUPAC Name7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline
SMILESCC1(c2ccnc3cc(Cl)ccc23)CCCN1
InChIInChI=1S/C14H15ClN2/c1-14(6-2-7-17-14)12-5-8-16-13-9-10(15)3-4-11(12)13/h3-5,8-9,17H,2,6-7H2,1H3
InChIKeyJAXBCHBFBFCLBV-UHFFFAOYSA-N
XLogP3.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline
CID 82664348
5-(2-methylpyrrolidin-2-yl)quinoline
CID 81231992
2-(2-chlorofuran-3-yl)-2-methylpyrrolidine
CID 82655515
2-[5-chloro-2-(methoxymethyl)phenyl]-2-methylpyrrolidine
CID 117352130
5-chloro-2-methoxy-6-(2-methylpyrrolidin-2-yl)quinoline
CID 117443421
2-[5-chloro-2-(cyclobutylmethoxy)phenyl]-2-methylpyrrolidine
CID 117449114
2-(4-chloro-2,3-dimethoxyphenyl)-2-methylpyrrolidine
CID 117392452
4,7-dichloroquinoline
CID 6866
2-(3,4-difluoro-2-methoxyphenyl)-2-methylpyrrolidine
CID 117326742
trans-(1S,2S)-2-N-[(4-chlorophenyl)methyl]-1,2-bis(7-chloroquinolin-4-yl)cyclohexane-1,2-diamine
CID 175725692
N-(azepan-4-yl)-7-chloroquinolin-4-amine
CID 107173682
4-[4,8-bis(7-chloroquinolin-4-yl)-1,4,8,11-tetrazacyclotetradec-1-yl]-7-chloroquinoline
CID 10747137

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline?
The IUPAC name of 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline (CID 20977046) is 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline.
What is the SMILES notation for 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline?
The canonical SMILES for 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline is CC1(c2ccnc3cc(Cl)ccc23)CCCN1.
What is the InChIKey of 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline?
The InChIKey is JAXBCHBFBFCLBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2/c1-14(6-2-7-17-14)12-5-8-16-13-9-10(15)3-4-11(12)13/h3-5,8-9,17H,2,6-7H2,1H3.
What are the key properties of 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline?
7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline has a molecular weight of 246.74 g/mol, XLogP of 3.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline is sourced from PubChem (CID 20977046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).