4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine

C11H13N5 — CID 133408710

IUPAC4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine
SMILESNc1ccc2c(NCC3CC3)ncnc2n1
InChIInChI=1S/C11H13N5/c12-9-4-3-8-10(13-5-7-1-2-7)14-6-15-11(8)16-9/h3-4,6-7H,1-2,5H2,(H3,12,13,14,15,16)
InChIKeyNBUUPGRBEYHPSM-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.43
Rot. Bonds3

About 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine

4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine (PubChem CID 133408710) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine.

Molecular Properties

Compound Name4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine
PubChem CID133408710
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC Name4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine
SMILESNc1ccc2c(NCC3CC3)ncnc2n1
InChIInChI=1S/C11H13N5/c12-9-4-3-8-10(13-5-7-1-2-7)14-6-15-11(8)16-9/h3-4,6-7H,1-2,5H2,(H3,12,13,14,15,16)
InChIKeyNBUUPGRBEYHPSM-UHFFFAOYSA-N
XLogP1.43
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine?
The IUPAC name of 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine (CID 133408710) is 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine.
What is the SMILES notation for 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine?
The canonical SMILES for 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine is Nc1ccc2c(NCC3CC3)ncnc2n1.
What is the InChIKey of 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine?
The InChIKey is NBUUPGRBEYHPSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5/c12-9-4-3-8-10(13-5-7-1-2-7)14-6-15-11(8)16-9/h3-4,6-7H,1-2,5H2,(H3,12,13,14,15,16).
What are the key properties of 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine?
4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine has a molecular weight of 215.26 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine is sourced from PubChem (CID 133408710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).