5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine

C16H24N6 — CID 176671330

IUPAC5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine
SMILESC1CC2(CC2)CN1.CNc1nc(N)nc2nc(C)cc(C)c12
InChIInChI=1S/C10H13N5.C6H11N/c1-5-4-6(2)13-9-7(5)8(12-3)14-10(11)15-9;1-2-6(1)3-4-7-5-6/h4H,1-3H3,(H3,11,12,13,14,15);7H,1-5H2
InChIKeyLEOVJWBANMBZQN-UHFFFAOYSA-N
MW300.41 g/mol
LogP2.03
Rot. Bonds1

About 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine

5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine (PubChem CID 176671330) has the molecular formula C16H24N6 and a molecular weight of 300.41 g/mol. Its IUPAC name is 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine
PubChem CID176671330
Molecular FormulaC16H24N6
Molecular Weight300.41 g/mol
Exact Mass300.21
IUPAC Name5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine
SMILESC1CC2(CC2)CN1.CNc1nc(N)nc2nc(C)cc(C)c12
InChIInChI=1S/C10H13N5.C6H11N/c1-5-4-6(2)13-9-7(5)8(12-3)14-10(11)15-9;1-2-6(1)3-4-7-5-6/h4H,1-3H3,(H3,11,12,13,14,15);7H,1-5H2
InChIKeyLEOVJWBANMBZQN-UHFFFAOYSA-N
XLogP2.03
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 52.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine (CID 176671330) is 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine is C1CC2(CC2)CN1.CNc1nc(N)nc2nc(C)cc(C)c12.
What is the InChIKey of 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is LEOVJWBANMBZQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5.C6H11N/c1-5-4-6(2)13-9-7(5)8(12-3)14-10(11)15-9;1-2-6(1)3-4-7-5-6/h4H,1-3H3,(H3,11,12,13,14,15);7H,1-5H2.
What are the key properties of 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine?
5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 300.41 g/mol, XLogP of 2.03, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-azaspiro[2.4]heptane;4-N,5,7-trimethylpyrido[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 176671330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).