methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride

C10H13ClN2O2 — CID 67958246

IUPACmethyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride
SMILESCOC(=O)c1ccc(C2(N)CC2)nc1.Cl
InChIInChI=1S/C10H12N2O2.ClH/c1-14-9(13)7-2-3-8(12-6-7)10(11)4-5-10;/h2-3,6H,4-5,11H2,1H3;1H
InChIKeyFGIBLDJMLZALLC-UHFFFAOYSA-N
MW228.68 g/mol
LogP1.24
Rot. Bonds2

About methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride

methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride (PubChem CID 67958246) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride.

Molecular Properties

Compound Namemethyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride
PubChem CID67958246
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Namemethyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride
SMILESCOC(=O)c1ccc(C2(N)CC2)nc1.Cl
InChIInChI=1S/C10H12N2O2.ClH/c1-14-9(13)7-2-3-8(12-6-7)10(11)4-5-10;/h2-3,6H,4-5,11H2,1H3;1H
InChIKeyFGIBLDJMLZALLC-UHFFFAOYSA-N
XLogP1.24
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 6-(1-hydroxycyclopropyl)pyridine-3-carboxylate
CID 131192690
methyl 6-[4-methyl-1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyridine-3-carboxylate
CID 162444918
methyl 6-(3-aminopropoxy)pyridine-3-carboxylate;hydrochloride
CID 166000008
methyl 6-(cyclopentylamino)pyridine-3-carboxylate
CID 154654018
methyl 6-(5-amino-2-pyridinyl)pyridine-3-carboxylate
CID 10633160
methyl 6-(methoxymethoxy)pyridine-3-carboxylate
CID 50896445
methyl 6-(dibromomethyl)pyridine-3-carboxylate;hydrochloride
CID 146048625
methyl 6-(trideuteriomethyl)pyridine-3-carboxylate
CID 59327576
methyl 6-methylsulfanylpyridine-3-carboxylate
CID 901959
2-O-ethyl 5-O-methyl pyridine-2,5-dicarboxylate
CID 152564133
methyl 6-[2-(methylamino)-1-[(2-methylpropan-2-yl)oxycarbonyl]cyclopropyl]pyridine-3-carboxylate
CID 155255595
methyl 6-(chloromethyl)pyridine-3-carboxylate
CID 15331516

Frequently Asked Questions

What is the IUPAC name of methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride?
The IUPAC name of methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride (CID 67958246) is methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride.
What is the SMILES notation for methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride?
The canonical SMILES for methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride is COC(=O)c1ccc(C2(N)CC2)nc1.Cl.
What is the InChIKey of methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride?
The InChIKey is FGIBLDJMLZALLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2.ClH/c1-14-9(13)7-2-3-8(12-6-7)10(11)4-5-10;/h2-3,6H,4-5,11H2,1H3;1H.
What are the key properties of methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride?
methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride has a molecular weight of 228.68 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-(1-aminocyclopropyl)pyridine-3-carboxylate;hydrochloride is sourced from PubChem (CID 67958246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).