(3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine

C10H9ClN4 — CID 103443848

IUPAC(3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine
SMILESNC(c1cncnc1)c1ncccc1Cl
InChIInChI=1S/C10H9ClN4/c11-8-2-1-3-15-10(8)9(12)7-4-13-6-14-5-7/h1-6,9H,12H2
InChIKeyVMYLUHMDGLFXKR-UHFFFAOYSA-N
MW220.66 g/mol
LogP1.57
Rot. Bonds2

About (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine

(3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine (PubChem CID 103443848) has the molecular formula C10H9ClN4 and a molecular weight of 220.66 g/mol. Its IUPAC name is (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine.

Molecular Properties

Compound Name(3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine
PubChem CID103443848
Molecular FormulaC10H9ClN4
Molecular Weight220.66 g/mol
Exact Mass220.05
IUPAC Name(3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine
SMILESNC(c1cncnc1)c1ncccc1Cl
InChIInChI=1S/C10H9ClN4/c11-8-2-1-3-15-10(8)9(12)7-4-13-6-14-5-7/h1-6,9H,12H2
InChIKeyVMYLUHMDGLFXKR-UHFFFAOYSA-N
XLogP1.57
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-chloro-2-pyridinyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 103444180
di(pyrimidin-5-yl)methanamine
CID 102923336
ethane;pyridin-3-yl(pyrimidin-5-yl)methanamine
CID 145185117
(3-chloro-2-pyridinyl)-quinolin-7-ylmethanamine
CID 103443918
(1S)-1-(3-chloro-2-pyridinyl)ethanamine
CID 103663393
(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine
CID 103443950
(3-chloro-2-pyridinyl)-(3-methyltriazol-4-yl)methanamine
CID 103443748
1-(3-chloro-2-pyridinyl)prop-2-yn-1-amine
CID 103443721
1-(3-chloro-2-pyridinyl)ethane-1,2-diamine
CID 55293817
2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanamine
CID 55078463
(2,6-dichlorophenyl)-pyridin-3-ylmethanamine
CID 115799088
(3-chloro-2-pyridinyl)-(3-cyclobutylphenyl)methanamine
CID 103443956

Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine?
The IUPAC name of (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine (CID 103443848) is (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine.
What is the SMILES notation for (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine?
The canonical SMILES for (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine is NC(c1cncnc1)c1ncccc1Cl.
What is the InChIKey of (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine?
The InChIKey is VMYLUHMDGLFXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4/c11-8-2-1-3-15-10(8)9(12)7-4-13-6-14-5-7/h1-6,9H,12H2.
What are the key properties of (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine?
(3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine has a molecular weight of 220.66 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-pyridinyl)-pyrimidin-5-ylmethanamine is sourced from PubChem (CID 103443848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).