7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine

C16H20ClN3 — CID 106642173

IUPAC7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine
SMILESCN(CC1CCCCN1)c1ccnc2cc(Cl)ccc12
InChIInChI=1S/C16H20ClN3/c1-20(11-13-4-2-3-8-18-13)16-7-9-19-15-10-12(17)5-6-14(15)16/h5-7,9-10,13,18H,2-4,8,11H2,1H3
InChIKeyGZPCEBWAOIRJTF-UHFFFAOYSA-N
MW289.81 g/mol
LogP3.47
Rot. Bonds3

About 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine

7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine (PubChem CID 106642173) has the molecular formula C16H20ClN3 and a molecular weight of 289.81 g/mol. Its IUPAC name is 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine
PubChem CID106642173
Molecular FormulaC16H20ClN3
Molecular Weight289.81 g/mol
Exact Mass289.13
IUPAC Name7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine
SMILESCN(CC1CCCCN1)c1ccnc2cc(Cl)ccc12
InChIInChI=1S/C16H20ClN3/c1-20(11-13-4-2-3-8-18-13)16-7-9-19-15-10-12(17)5-6-14(15)16/h5-7,9-10,13,18H,2-4,8,11H2,1H3
InChIKeyGZPCEBWAOIRJTF-UHFFFAOYSA-N
XLogP3.47
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.81
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-N-methyl-N-(piperidin-4-ylmethyl)quinolin-4-amine
CID 79719664
7-chloro-N-methyl-N-(piperidin-3-ylmethyl)quinolin-4-amine
CID 106642854
7-chloro-N-ethyl-N-methylquinolin-4-amine
CID 123939218
4-chloro-N-methyl-N-[[(2R)-piperidin-2-yl]methyl]pyrimidin-2-amine
CID 97164172
2-chloro-N-methyl-N-[[(2S)-piperidin-2-yl]methyl]pyrimidin-4-amine
CID 97164149
2-[(7-chloroquinolin-4-yl)-methylamino]ethanol
CID 60631611
N,2-dimethyl-N-(piperidin-2-ylmethyl)quinolin-4-amine
CID 106642115
1-[(7-chloroquinolin-4-yl)-methylamino]propan-2-ol
CID 55061126
N-(2-bromoethyl)-7-chloro-N-cyclohexylquinolin-4-amine
CID 80666227
7-chloro-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]quinolin-4-amine
CID 104973339
7-chloro-4-(cyclohexylmethyl)quinoline
CID 122374976
2-[5-chloro-2-[methyl-[[(2S)-pyrrolidin-2-yl]methyl]amino]phenyl]-N,N-dimethylprop-2-enamide
CID 155132143

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine?
The IUPAC name of 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine (CID 106642173) is 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine.
What is the SMILES notation for 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine?
The canonical SMILES for 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine is CN(CC1CCCCN1)c1ccnc2cc(Cl)ccc12.
What is the InChIKey of 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine?
The InChIKey is GZPCEBWAOIRJTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3/c1-20(11-13-4-2-3-8-18-13)16-7-9-19-15-10-12(17)5-6-14(15)16/h5-7,9-10,13,18H,2-4,8,11H2,1H3.
What are the key properties of 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine?
7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine has a molecular weight of 289.81 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine is sourced from PubChem (CID 106642173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).