N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride

C15H21Cl2N3 — CID 119923035

IUPACN-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride
SMILESCN(Cc1ccc2ccccc2n1)C1CCNC1.Cl.Cl
InChIInChI=1S/C15H19N3.2ClH/c1-18(14-8-9-16-10-14)11-13-7-6-12-4-2-3-5-15(12)17-13;;/h2-7,14,16H,8-11H2,1H3;2*1H
InChIKeyJKOWZJIMJFTTBT-UHFFFAOYSA-N
MW314.26 g/mol
LogP2.87
Rot. Bonds3

About N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride

N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride (PubChem CID 119923035) has the molecular formula C15H21Cl2N3 and a molecular weight of 314.26 g/mol. Its IUPAC name is N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride.

Molecular Properties

Compound NameN-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride
PubChem CID119923035
Molecular FormulaC15H21Cl2N3
Molecular Weight314.26 g/mol
Exact Mass313.11
IUPAC NameN-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride
SMILESCN(Cc1ccc2ccccc2n1)C1CCNC1.Cl.Cl
InChIInChI=1S/C15H19N3.2ClH/c1-18(14-8-9-16-10-14)11-13-7-6-12-4-2-3-5-15(12)17-13;;/h2-7,14,16H,8-11H2,1H3;2*1H
InChIKeyJKOWZJIMJFTTBT-UHFFFAOYSA-N
XLogP2.87
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.26
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-methyl-4-N-(quinolin-2-ylmethyl)cyclohexane-1,4-diamine
CID 79112911
N-[(2-chloroquinolin-3-yl)methyl]-N-methylpyrrolidin-3-amine
CID 63301282
N-propyl-N-(quinolin-2-ylmethyl)piperidin-3-amine
CID 63638032
(3S)-N-methyl-N-(quinolin-2-ylmethyl)thiolan-3-amine
CID 97093086
N-methyl-1,1-dioxo-N-(quinolin-2-ylmethyl)thiolan-3-amine
CID 75682393
(3S)-N-methyl-1,1-dioxo-N-(quinolin-2-ylmethyl)thiolan-3-amine
CID 51598738
N-benzyl-N-methylpyrrolidin-3-amine
CID 14834678
N-methyl-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]pyrrolidin-3-amine
CID 63297902
1-[[methyl(pyrrolidin-3-yl)amino]methyl]naphthalen-2-ol
CID 63296957
N-methyl-N-piperidin-3-ylquinolin-2-amine
CID 63642355
2-bromo-N-methyl-N-(quinolin-2-ylmethyl)cyclohexan-1-amine
CID 102637233
2-(dimethylamino)-4-[[methyl(pyrrolidin-3-yl)amino]methyl]-1H-pyrimidin-6-one;dihydrochloride
CID 137049928

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride?
The IUPAC name of N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride (CID 119923035) is N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride.
What is the SMILES notation for N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride?
The canonical SMILES for N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride is CN(Cc1ccc2ccccc2n1)C1CCNC1.Cl.Cl.
What is the InChIKey of N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride?
The InChIKey is JKOWZJIMJFTTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3.2ClH/c1-18(14-8-9-16-10-14)11-13-7-6-12-4-2-3-5-15(12)17-13;;/h2-7,14,16H,8-11H2,1H3;2*1H.
What are the key properties of N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride?
N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride has a molecular weight of 314.26 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride is sourced from PubChem (CID 119923035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).