7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine

C14H16ClN3 — CID 57199203

IUPAC7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine
SMILESCN1CC[C@@H](Nc2ccnc3cc(Cl)ccc23)C1
InChIInChI=1S/C14H16ClN3/c1-18-7-5-11(9-18)17-13-4-6-16-14-8-10(15)2-3-12(13)14/h2-4,6,8,11H,5,7,9H2,1H3,(H,16,17)/t11-/m1/s1
InChIKeyLWOWUHWFPBFQJE-LLVKDONJSA-N
MW261.76 g/mol
LogP3.00
Rot. Bonds2

About 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine

7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine (PubChem CID 57199203) has the molecular formula C14H16ClN3 and a molecular weight of 261.76 g/mol. Its IUPAC name is 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine
PubChem CID57199203
Molecular FormulaC14H16ClN3
Molecular Weight261.76 g/mol
Exact Mass261.10
IUPAC Name7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine
SMILESCN1CC[C@@H](Nc2ccnc3cc(Cl)ccc23)C1
InChIInChI=1S/C14H16ClN3/c1-18-7-5-11(9-18)17-13-4-6-16-14-8-10(15)2-3-12(13)14/h2-4,6,8,11H,5,7,9H2,1H3,(H,16,17)/t11-/m1/s1
InChIKeyLWOWUHWFPBFQJE-LLVKDONJSA-N
XLogP3.00
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.76
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-N-(1-propylpiperidin-4-yl)quinolin-4-amine
CID 60667072
7-chloro-N-[(3R)-pyrrolidin-3-yl]quinolin-4-amine
CID 67618697
7-chloro-N-(3-ethylcyclohexyl)quinolin-4-amine
CID 64742610
N-(1-methylpyrrolidin-3-yl)quinolin-5-amine
CID 62975948
7-chloro-N-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)quinolin-4-amine
CID 133281768
7-chloro-N-(3-methylsulfanylcyclopentyl)quinolin-4-amine
CID 103704139
4-N-(7-chloroquinolin-4-yl)-1-N-(2-methylpropyl)cyclohexane-1,4-diamine
CID 69198675
N-(azepan-4-yl)-7-chloroquinolin-4-amine
CID 107173682
N-[1-[(4-bromo-3,5-diethoxyphenyl)methyl]piperidin-4-yl]-7-chloroquinolin-4-amine
CID 67197279
1-N,4-N-bis(7-chloroquinolin-4-yl)piperazine-1,4-diamine
CID 591300
4-N-(1-methylpyrrolidin-3-yl)quinoline-4,8-diamine
CID 83061261
N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide
CID 10237562

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine?
The IUPAC name of 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine (CID 57199203) is 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine.
What is the SMILES notation for 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine?
The canonical SMILES for 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine is CN1CC[C@@H](Nc2ccnc3cc(Cl)ccc23)C1.
What is the InChIKey of 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine?
The InChIKey is LWOWUHWFPBFQJE-LLVKDONJSA-N. The full InChI is InChI=1S/C14H16ClN3/c1-18-7-5-11(9-18)17-13-4-6-16-14-8-10(15)2-3-12(13)14/h2-4,6,8,11H,5,7,9H2,1H3,(H,16,17)/t11-/m1/s1.
What are the key properties of 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine?
7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine has a molecular weight of 261.76 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine is sourced from PubChem (CID 57199203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).