N-methylisoquinolin-5-amine;hydrochloride

C10H11ClN2 — CID 135905265

IUPACN-methylisoquinolin-5-amine;hydrochloride
SMILESCNc1cccc2cnccc12.Cl
InChIInChI=1S/C10H10N2.ClH/c1-11-10-4-2-3-8-7-12-6-5-9(8)10;/h2-7,11H,1H3;1H
InChIKeyBEAPVHWIOKCVEW-UHFFFAOYSA-N
MW194.66 g/mol
LogP2.70
Rot. Bonds1

About N-methylisoquinolin-5-amine;hydrochloride

N-methylisoquinolin-5-amine;hydrochloride (PubChem CID 135905265) has the molecular formula C10H11ClN2 and a molecular weight of 194.66 g/mol. Its IUPAC name is N-methylisoquinolin-5-amine;hydrochloride.

Molecular Properties

Compound NameN-methylisoquinolin-5-amine;hydrochloride
PubChem CID135905265
Molecular FormulaC10H11ClN2
Molecular Weight194.66 g/mol
Exact Mass194.06
IUPAC NameN-methylisoquinolin-5-amine;hydrochloride
SMILESCNc1cccc2cnccc12.Cl
InChIInChI=1S/C10H10N2.ClH/c1-11-10-4-2-3-8-7-12-6-5-9(8)10;/h2-7,11H,1H3;1H
InChIKeyBEAPVHWIOKCVEW-UHFFFAOYSA-N
XLogP2.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.66
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,1-dimethylisoquinolin-5-amine;N-methylisoquinolin-5-amine
CID 156839455
4-N-isoquinolin-5-yl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80789872
4-N-isoquinolin-5-yl-2-N,5-dimethylpyrimidine-2,4-diamine
CID 80789513
N-[(2R)-butan-2-yl]isoquinolin-5-amine
CID 93261822
5-(sulfinoamino)isoquinoline
CID 67429142
isoquinolin-5-ylthiourea
CID 1480924
3-(isoquinolin-5-ylamino)-2,2-dimethylpropan-1-ol
CID 81413794
2-(isoquinolin-5-ylamino)propanoic acid
CID 66172493
N-(4,6-dichloro-1,3,5-triazin-2-yl)isoquinolin-5-amine
CID 62869400
2-amino-N-isoquinolin-5-yl-2-methylpropanamide
CID 61264999
(2E)-2-(isoquinolin-5-ylhydrazinylidene)propanoic acid
CID 13266426
N-isoquinolin-5-yl-2-(methylamino)pyridine-4-carboxamide
CID 62180377

Frequently Asked Questions

What is the IUPAC name of N-methylisoquinolin-5-amine;hydrochloride?
The IUPAC name of N-methylisoquinolin-5-amine;hydrochloride (CID 135905265) is N-methylisoquinolin-5-amine;hydrochloride.
What is the SMILES notation for N-methylisoquinolin-5-amine;hydrochloride?
The canonical SMILES for N-methylisoquinolin-5-amine;hydrochloride is CNc1cccc2cnccc12.Cl.
What is the InChIKey of N-methylisoquinolin-5-amine;hydrochloride?
The InChIKey is BEAPVHWIOKCVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2.ClH/c1-11-10-4-2-3-8-7-12-6-5-9(8)10;/h2-7,11H,1H3;1H.
What are the key properties of N-methylisoquinolin-5-amine;hydrochloride?
N-methylisoquinolin-5-amine;hydrochloride has a molecular weight of 194.66 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylisoquinolin-5-amine;hydrochloride is sourced from PubChem (CID 135905265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).