N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine

C10H17N5 — CID 83833883

IUPACN'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine
SMILESCc1nc(NCCN)nc2c1CN(C)C2
InChIInChI=1S/C10H17N5/c1-7-8-5-15(2)6-9(8)14-10(13-7)12-4-3-11/h3-6,11H2,1-2H3,(H,12,13,14)
InChIKeyYJNRZAIECRCJOR-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.10
Rot. Bonds3

About N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine

N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine (PubChem CID 83833883) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine
PubChem CID83833883
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC NameN'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine
SMILESCc1nc(NCCN)nc2c1CN(C)C2
InChIInChI=1S/C10H17N5/c1-7-8-5-15(2)6-9(8)14-10(13-7)12-4-3-11/h3-6,11H2,1-2H3,(H,12,13,14)
InChIKeyYJNRZAIECRCJOR-UHFFFAOYSA-N
XLogP0.10
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N'-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine
CID 83830462
N'-(4-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-2-yl)propane-1,3-diamine
CID 83839523
4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine
CID 83862337
N'-(7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-5-yl)ethane-1,2-diamine
CID 83834527
2-N,4-N-bis(2-aminoethyl)-6-N-butyl-1,3,5-triazine-2,4,6-triamine
CID 118119736
N'-(7-methyl-6,8-dihydro-5H-1,7-naphthyridin-2-yl)ethane-1,2-diamine
CID 83833578
N'-(7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)ethane-1,2-diamine
CID 83833878
ethane;2,4,7-trimethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 91352697
2-(6-methyl-2-methylsulfanyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-yl)ethanamine
CID 83871417
3-[(4-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)amino]propanoic acid
CID 83839024
1,4,6-trimethyl-5,7-dihydropyrrolo[3,4-d]pyridazine
CID 174263206
(4-methyl-6-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)cyanamide
CID 53215329

Frequently Asked Questions

What is the IUPAC name of N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine?
The IUPAC name of N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine (CID 83833883) is N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine is Cc1nc(NCCN)nc2c1CN(C)C2.
What is the InChIKey of N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine?
The InChIKey is YJNRZAIECRCJOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-7-8-5-15(2)6-9(8)14-10(13-7)12-4-3-11/h3-6,11H2,1-2H3,(H,12,13,14).
What are the key properties of N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine?
N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine has a molecular weight of 207.28 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4,6-dimethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 83833883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).