propane;pyrido[3,2-d]pyrimidine

C10H13N3 — CID 144881600

IUPACpropane;pyrido[3,2-d]pyrimidine
SMILESCCC.c1cnc2cncnc2c1
InChIInChI=1S/C7H5N3.C3H8/c1-2-6-7(9-3-1)4-8-5-10-6;1-3-2/h1-5H;3H2,1-2H3
InChIKeyDHXFYIFGZZOBID-UHFFFAOYSA-N
MW175.24 g/mol
LogP2.44
Rot. Bonds

About propane;pyrido[3,2-d]pyrimidine

propane;pyrido[3,2-d]pyrimidine (PubChem CID 144881600) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is propane;pyrido[3,2-d]pyrimidine.

Molecular Properties

Compound Namepropane;pyrido[3,2-d]pyrimidine
PubChem CID144881600
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC Namepropane;pyrido[3,2-d]pyrimidine
SMILESCCC.c1cnc2cncnc2c1
InChIInChI=1S/C7H5N3.C3H8/c1-2-6-7(9-3-1)4-8-5-10-6;1-3-2/h1-5H;3H2,1-2H3
InChIKeyDHXFYIFGZZOBID-UHFFFAOYSA-N
XLogP2.44
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;1,5-naphthyridine;propane
CID 142434189
pyrido[3,2-d]pyrimidine;6H-pyrrolo[3,4-d]pyrimidine
CID 174480694
pyrido[3,2-d]pyrimidine;pyrido[3,4-d]pyrimidine;pyrido[4,3-d]pyrimidine
CID 67067545
CID 175543320
CID 175543320
iridium(3+);1,5-naphthyridine
CID 175728214
ethane;tetrakis(2-methylpropane);1,5-naphthyridine;1,8-naphthyridine;quinazoline;quinoline
CID 159253000
2-ethylpyrido[3,2-d]pyrimidine
CID 118375841
cinnoline;ethane;isoquinoline;naphthalene;quinazoline;quinoline;quinoxaline
CID 158080804
butane;quinoxaline
CID 143489739
1,5-naphthyridine;pyridine
CID 158398713
cinnoline;ethane;isoquinoline;naphthalene;1,5-naphthyridine;1,8-naphthyridine;quinazoline;quinoline;quinoxaline
CID 158115391
5-(2,2-dimethylpropyl)-1,7-naphthyridine
CID 130455577

Frequently Asked Questions

What is the IUPAC name of propane;pyrido[3,2-d]pyrimidine?
The IUPAC name of propane;pyrido[3,2-d]pyrimidine (CID 144881600) is propane;pyrido[3,2-d]pyrimidine.
What is the SMILES notation for propane;pyrido[3,2-d]pyrimidine?
The canonical SMILES for propane;pyrido[3,2-d]pyrimidine is CCC.c1cnc2cncnc2c1.
What is the InChIKey of propane;pyrido[3,2-d]pyrimidine?
The InChIKey is DHXFYIFGZZOBID-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N3.C3H8/c1-2-6-7(9-3-1)4-8-5-10-6;1-3-2/h1-5H;3H2,1-2H3.
What are the key properties of propane;pyrido[3,2-d]pyrimidine?
propane;pyrido[3,2-d]pyrimidine has a molecular weight of 175.24 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propane;pyrido[3,2-d]pyrimidine is sourced from PubChem (CID 144881600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).