3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride

C10H12ClN3S — CID 171230932

IUPAC3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride
SMILESCl.Nc1ncccc1[C@@H](N)c1cccs1
InChIInChI=1S/C10H11N3S.ClH/c11-9(8-4-2-6-14-8)7-3-1-5-13-10(7)12;/h1-6,9H,11H2,(H2,12,13);1H/t9-;/m1./s1
InChIKeyLKYZHMPVXLJYMP-SBSPUUFOSA-N
MW241.75 g/mol
LogP2.20
Rot. Bonds2

About 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride

3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride (PubChem CID 171230932) has the molecular formula C10H12ClN3S and a molecular weight of 241.75 g/mol. Its IUPAC name is 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride
PubChem CID171230932
Molecular FormulaC10H12ClN3S
Molecular Weight241.75 g/mol
Exact Mass241.04
IUPAC Name3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride
SMILESCl.Nc1ncccc1[C@@H](N)c1cccs1
InChIInChI=1S/C10H11N3S.ClH/c11-9(8-4-2-6-14-8)7-3-1-5-13-10(7)12;/h1-6,9H,11H2,(H2,12,13);1H/t9-;/m1./s1
InChIKeyLKYZHMPVXLJYMP-SBSPUUFOSA-N
XLogP2.20
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.75
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride?
The IUPAC name of 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride (CID 171230932) is 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride.
What is the SMILES notation for 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride?
The canonical SMILES for 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride is Cl.Nc1ncccc1[C@@H](N)c1cccs1.
What is the InChIKey of 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride?
The InChIKey is LKYZHMPVXLJYMP-SBSPUUFOSA-N. The full InChI is InChI=1S/C10H11N3S.ClH/c11-9(8-4-2-6-14-8)7-3-1-5-13-10(7)12;/h1-6,9H,11H2,(H2,12,13);1H/t9-;/m1./s1.
What are the key properties of 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride?
3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride has a molecular weight of 241.75 g/mol, XLogP of 2.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride is sourced from PubChem (CID 171230932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).