2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride

C11H19ClN4 — CID 82022940

IUPAC2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride
SMILESCc1cc(CCN)nc(N2CCCC2)n1.Cl
InChIInChI=1S/C11H18N4.ClH/c1-9-8-10(4-5-12)14-11(13-9)15-6-2-3-7-15;/h8H,2-7,12H2,1H3;1H
InChIKeyCTCLEWJBJXJQIF-UHFFFAOYSA-N
MW242.75 g/mol
LogP1.31
Rot. Bonds3

About 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride

2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride (PubChem CID 82022940) has the molecular formula C11H19ClN4 and a molecular weight of 242.75 g/mol. Its IUPAC name is 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride
PubChem CID82022940
Molecular FormulaC11H19ClN4
Molecular Weight242.75 g/mol
Exact Mass242.13
IUPAC Name2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride
SMILESCc1cc(CCN)nc(N2CCCC2)n1.Cl
InChIInChI=1S/C11H18N4.ClH/c1-9-8-10(4-5-12)14-11(13-9)15-6-2-3-7-15;/h8H,2-7,12H2,1H3;1H
InChIKeyCTCLEWJBJXJQIF-UHFFFAOYSA-N
XLogP1.31
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-ethylpiperazin-1-yl)-6-methylpyrimidin-4-yl]ethanamine;hydrochloride
CID 82022831
[2-(azocan-1-yl)-6-methylpyrimidin-4-yl]methanamine
CID 107541533
4-(chloromethyl)-6-methyl-2-pyrrolidin-1-ylpyrimidine
CID 62745550
2-(azetidin-1-yl)-4-methyl-6-octylpyrimidine
CID 145141912
N-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]propan-2-amine
CID 55114190
[6-methyl-2-(4-methylazepan-1-yl)pyrimidin-4-yl]methanamine
CID 107542020
1-[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]butan-2-amine
CID 62745059
1-(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)butan-2-amine
CID 55114152
[6-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-4-yl]methanamine
CID 107541514
1,4-bis(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane
CID 99786904
[6-methyl-2-(1-oxo-1,4-thiazinan-4-yl)pyrimidin-4-yl]methanamine
CID 107541777
N-[[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
CID 55114380

Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride (CID 82022940) is 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride is Cc1cc(CCN)nc(N2CCCC2)n1.Cl.
What is the InChIKey of 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride?
The InChIKey is CTCLEWJBJXJQIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4.ClH/c1-9-8-10(4-5-12)14-11(13-9)15-6-2-3-7-15;/h8H,2-7,12H2,1H3;1H.
What are the key properties of 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride?
2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)ethanamine;hydrochloride is sourced from PubChem (CID 82022940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).