2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine

C14H14N6 — CID 135390677

IUPAC2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine
SMILESCC1(Nc2nc(-c3cnc[nH]3)nc3cnccc23)CC1
InChIInChI=1S/C14H14N6/c1-14(3-4-14)20-12-9-2-5-15-6-10(9)18-13(19-12)11-7-16-8-17-11/h2,5-8H,3-4H2,1H3,(H,16,17)(H,18,19,20)
InChIKeyKYOJYBUWMHUNGS-UHFFFAOYSA-N
MW266.31 g/mol
LogP2.38
Rot. Bonds3

About 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine

2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine (PubChem CID 135390677) has the molecular formula C14H14N6 and a molecular weight of 266.31 g/mol. Its IUPAC name is 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine
PubChem CID135390677
Molecular FormulaC14H14N6
Molecular Weight266.31 g/mol
Exact Mass266.13
IUPAC Name2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine
SMILESCC1(Nc2nc(-c3cnc[nH]3)nc3cnccc23)CC1
InChIInChI=1S/C14H14N6/c1-14(3-4-14)20-12-9-2-5-15-6-10(9)18-13(19-12)11-7-16-8-17-11/h2,5-8H,3-4H2,1H3,(H,16,17)(H,18,19,20)
InChIKeyKYOJYBUWMHUNGS-UHFFFAOYSA-N
XLogP2.38
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-methylcyclopropyl)-2-(1,3-oxazol-5-yl)pyrido[3,4-d]pyrimidin-4-amine
CID 135368048
N-(1-methylcyclopropyl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrido[3,4-d]pyrimidin-4-amine
CID 135368330
8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
CID 135368386
N-propyl-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
CID 135368629
4-N-(1-methylcyclopropyl)-7-(1H-pyrazol-5-yl)quinazoline-2,4-diamine
CID 154649381
N-(1-methylcyclobutyl)-2-pyrimidin-4-yl-1,7-naphthyridin-4-amine
CID 135390576
N,2-dimethylpyrido[3,4-d]pyrimidin-4-amine
CID 88990244
2-phenyl-N-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
CID 11771006
N-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
CID 135368753
2-(1H-imidazol-5-yl)quinazoline
CID 91268038
2-methyl-2-[(2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-yl)amino]propan-1-ol
CID 135368371
1-[(2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-yl)amino]propan-1-ol
CID 172774618

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine (CID 135390677) is 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine is CC1(Nc2nc(-c3cnc[nH]3)nc3cnccc23)CC1.
What is the InChIKey of 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine?
The InChIKey is KYOJYBUWMHUNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6/c1-14(3-4-14)20-12-9-2-5-15-6-10(9)18-13(19-12)11-7-16-8-17-11/h2,5-8H,3-4H2,1H3,(H,16,17)(H,18,19,20).
What are the key properties of 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine?
2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine has a molecular weight of 266.31 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 135390677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).