2-chloropyrido[2,3-d]pyrimidin-7-amine

C7H5ClN4 — CID 84718433

IUPAC2-chloropyrido[2,3-d]pyrimidin-7-amine
SMILESNc1ccc2cnc(Cl)nc2n1
InChIInChI=1S/C7H5ClN4/c8-7-10-3-4-1-2-5(9)11-6(4)12-7/h1-3H,(H2,9,10,11,12)
InChIKeySFBXTTXKQAILEL-UHFFFAOYSA-N
MW180.60 g/mol
LogP1.26
Rot. Bonds

About 2-chloropyrido[2,3-d]pyrimidin-7-amine

2-chloropyrido[2,3-d]pyrimidin-7-amine (PubChem CID 84718433) has the molecular formula C7H5ClN4 and a molecular weight of 180.60 g/mol. Its IUPAC name is 2-chloropyrido[2,3-d]pyrimidin-7-amine.

Molecular Properties

Compound Name2-chloropyrido[2,3-d]pyrimidin-7-amine
PubChem CID84718433
Molecular FormulaC7H5ClN4
Molecular Weight180.60 g/mol
Exact Mass180.02
IUPAC Name2-chloropyrido[2,3-d]pyrimidin-7-amine
SMILESNc1ccc2cnc(Cl)nc2n1
InChIInChI=1S/C7H5ClN4/c8-7-10-3-4-1-2-5(9)11-6(4)12-7/h1-3H,(H2,9,10,11,12)
InChIKeySFBXTTXKQAILEL-UHFFFAOYSA-N
XLogP1.26
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.60
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

pyrido[2,3-d]pyrimidine-2,7-diamine
CID 22134678
2-pentylpyrido[2,3-d]pyrimidin-7-amine
CID 67700184
2,8-dichloro-9-methylpyrimido[4,5-b]quinoline
CID 84639415
2-chloro-1,6-naphthyridin-7-amine
CID 138605042
9-bromo-2-chloropyrimido[4,5-b]quinoline
CID 84644107
2-chlorothieno[2,3-d]pyrimidin-6-amine
CID 126970535
6-propan-2-yl-1,8-naphthyridin-2-amine
CID 155176084
5,6-dichloropyridin-2-amine
CID 53485506
[1,2]oxazolo[3,4-b]pyridin-6-amine
CID 162789117
7-bromo-2-chloroquinazolin-8-ol
CID 59199227
6-chloropyridin-2-amine;ethane
CID 143370846
5-chloro-6-iodopyridin-2-amine
CID 130701003

Frequently Asked Questions

What is the IUPAC name of 2-chloropyrido[2,3-d]pyrimidin-7-amine?
The IUPAC name of 2-chloropyrido[2,3-d]pyrimidin-7-amine (CID 84718433) is 2-chloropyrido[2,3-d]pyrimidin-7-amine.
What is the SMILES notation for 2-chloropyrido[2,3-d]pyrimidin-7-amine?
The canonical SMILES for 2-chloropyrido[2,3-d]pyrimidin-7-amine is Nc1ccc2cnc(Cl)nc2n1.
What is the InChIKey of 2-chloropyrido[2,3-d]pyrimidin-7-amine?
The InChIKey is SFBXTTXKQAILEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN4/c8-7-10-3-4-1-2-5(9)11-6(4)12-7/h1-3H,(H2,9,10,11,12).
What are the key properties of 2-chloropyrido[2,3-d]pyrimidin-7-amine?
2-chloropyrido[2,3-d]pyrimidin-7-amine has a molecular weight of 180.60 g/mol, XLogP of 1.26, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloropyrido[2,3-d]pyrimidin-7-amine is sourced from PubChem (CID 84718433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).