N-methyl-1-pyridin-3-ylmethanamine;hydrochloride

C7H11ClN2 — CID 17290665

IUPACN-methyl-1-pyridin-3-ylmethanamine;hydrochloride
SMILESCNCc1cccnc1.Cl
InChIInChI=1S/C7H10N2.ClH/c1-8-5-7-3-2-4-9-6-7;/h2-4,6,8H,5H2,1H3;1H
InChIKeyQQPMDLGNKITTNG-UHFFFAOYSA-N
MW158.63 g/mol
LogP1.22
Rot. Bonds2

About N-methyl-1-pyridin-3-ylmethanamine;hydrochloride

N-methyl-1-pyridin-3-ylmethanamine;hydrochloride (PubChem CID 17290665) has the molecular formula C7H11ClN2 and a molecular weight of 158.63 g/mol. Its IUPAC name is N-methyl-1-pyridin-3-ylmethanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-pyridin-3-ylmethanamine;hydrochloride
PubChem CID17290665
Molecular FormulaC7H11ClN2
Molecular Weight158.63 g/mol
Exact Mass158.06
IUPAC NameN-methyl-1-pyridin-3-ylmethanamine;hydrochloride
SMILESCNCc1cccnc1.Cl
InChIInChI=1S/C7H10N2.ClH/c1-8-5-7-3-2-4-9-6-7;/h2-4,6,8H,5H2,1H3;1H
InChIKeyQQPMDLGNKITTNG-UHFFFAOYSA-N
XLogP1.22
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.63
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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3-(pyridin-3-ylmethyl)pyridine
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1-pyridin-4-yl-N-(pyridin-3-ylmethyl)methanamine;dihydrochloride
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N-methyl-1-[3-(pyridin-3-ylmethylsulfanyl)phenyl]methanamine
CID 66346653
N-(pyridin-3-ylmethyl)pyridin-3-amine
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5-(methylaminomethyl)-N-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-amine
CID 106967245
2-methoxy-N-(pyridin-3-ylmethyl)ethanamine;hydrochloride
CID 17294523
2,4,4-trimethyl-N-(pyridin-3-ylmethyl)pentan-2-amine;hydrochloride
CID 6463081
3-ethylpyridine
CID 10823
N-(pyridin-3-ylmethyl)octan-1-amine;hydrochloride
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N-methyl-1-phenylmethanamine;hydrate;hydrochloride
CID 174315758

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyridin-3-ylmethanamine;hydrochloride?
The IUPAC name of N-methyl-1-pyridin-3-ylmethanamine;hydrochloride (CID 17290665) is N-methyl-1-pyridin-3-ylmethanamine;hydrochloride.
What is the SMILES notation for N-methyl-1-pyridin-3-ylmethanamine;hydrochloride?
The canonical SMILES for N-methyl-1-pyridin-3-ylmethanamine;hydrochloride is CNCc1cccnc1.Cl.
What is the InChIKey of N-methyl-1-pyridin-3-ylmethanamine;hydrochloride?
The InChIKey is QQPMDLGNKITTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2.ClH/c1-8-5-7-3-2-4-9-6-7;/h2-4,6,8H,5H2,1H3;1H.
What are the key properties of N-methyl-1-pyridin-3-ylmethanamine;hydrochloride?
N-methyl-1-pyridin-3-ylmethanamine;hydrochloride has a molecular weight of 158.63 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyridin-3-ylmethanamine;hydrochloride is sourced from PubChem (CID 17290665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).