(2-amino-4-phenylmethoxypteridin-6-yl)methanol

C14H13N5O2 — CID 11150259

IUPAC(2-amino-4-phenylmethoxypteridin-6-yl)methanol
SMILESNc1nc(OCc2ccccc2)c2nc(CO)cnc2n1
InChIInChI=1S/C14H13N5O2/c15-14-18-12-11(17-10(7-20)6-16-12)13(19-14)21-8-9-4-2-1-3-5-9/h1-6,20H,7-8H2,(H2,15,16,18,19)
InChIKeyKDKRBCAPXKZBRR-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.07
Rot. Bonds4

About (2-amino-4-phenylmethoxypteridin-6-yl)methanol

(2-amino-4-phenylmethoxypteridin-6-yl)methanol (PubChem CID 11150259) has the molecular formula C14H13N5O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is (2-amino-4-phenylmethoxypteridin-6-yl)methanol.

Molecular Properties

Compound Name(2-amino-4-phenylmethoxypteridin-6-yl)methanol
PubChem CID11150259
Molecular FormulaC14H13N5O2
Molecular Weight283.29 g/mol
Exact Mass283.11
IUPAC Name(2-amino-4-phenylmethoxypteridin-6-yl)methanol
SMILESNc1nc(OCc2ccccc2)c2nc(CO)cnc2n1
InChIInChI=1S/C14H13N5O2/c15-14-18-12-11(17-10(7-20)6-16-12)13(19-14)21-8-9-4-2-1-3-5-9/h1-6,20H,7-8H2,(H2,15,16,18,19)
InChIKeyKDKRBCAPXKZBRR-UHFFFAOYSA-N
XLogP1.07
TPSA107.04 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

Pteridine, 2-amino-4-benzoxy-
CID 10332482
O6-(R)-Roscovitine, R-2-(6-benzyloxy-9-isopropyl-9H-purin-2-ylamino)-butan-1-OL
CID 4369502
6,7-Dimethyl-4-phenylmethoxypteridin-2-amine
CID 822237
O6-[p-(Hydroxymethyl)benzyl]guanine, 98%
CID 10107220
9H-Purine-9-acetonitrile, 2-amino-6-(phenylmethoxy)-
CID 10468863
2-Amino-6-benzyloxy-9-(4-hydroxy-3-hydroxymethylbut-1-yl)purine
CID 13869778
2-Amino-4-phenylmethoxypteridine-6-carboxylic acid
CID 11289475
2-Amino-4-phenylmethoxypteridine-6-carbaldehyde
CID 11312050
1-(2-Amino-6-phenylmethoxypurin-9-yl)butan-2-ol
CID 10403297
6-(4-Ethoxyphenyl)-4-propan-2-yloxypteridin-2-amine
CID 11151514
6-(4-Methoxyphenyl)-4-propan-2-yloxypteridin-2-amine
CID 11197698
6-(3,4-Difluorophenyl)-4-propan-2-yloxypteridin-2-amine
CID 11232353

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-phenylmethoxypteridin-6-yl)methanol?
The IUPAC name of (2-amino-4-phenylmethoxypteridin-6-yl)methanol (CID 11150259) is (2-amino-4-phenylmethoxypteridin-6-yl)methanol.
What is the SMILES notation for (2-amino-4-phenylmethoxypteridin-6-yl)methanol?
The canonical SMILES for (2-amino-4-phenylmethoxypteridin-6-yl)methanol is Nc1nc(OCc2ccccc2)c2nc(CO)cnc2n1.
What is the InChIKey of (2-amino-4-phenylmethoxypteridin-6-yl)methanol?
The InChIKey is KDKRBCAPXKZBRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O2/c15-14-18-12-11(17-10(7-20)6-16-12)13(19-14)21-8-9-4-2-1-3-5-9/h1-6,20H,7-8H2,(H2,15,16,18,19).
What are the key properties of (2-amino-4-phenylmethoxypteridin-6-yl)methanol?
(2-amino-4-phenylmethoxypteridin-6-yl)methanol has a molecular weight of 283.29 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-phenylmethoxypteridin-6-yl)methanol is sourced from PubChem (CID 11150259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).