N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine

C10H14N4 — CID 119084586

IUPACN,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine
SMILESCc1[nH]c2cncnc2c1CN(C)C
InChIInChI=1S/C10H14N4/c1-7-8(5-14(2)3)10-9(13-7)4-11-6-12-10/h4,6,13H,5H2,1-3H3
InChIKeyOIFJGTQGTDTOPC-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.33
Rot. Bonds2

About N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine

N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine (PubChem CID 119084586) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine
PubChem CID119084586
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC NameN,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine
SMILESCc1[nH]c2cncnc2c1CN(C)C
InChIInChI=1S/C10H14N4/c1-7-8(5-14(2)3)10-9(13-7)4-11-6-12-10/h4,6,13H,5H2,1-3H3
InChIKeyOIFJGTQGTDTOPC-UHFFFAOYSA-N
XLogP1.33
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine (CID 119084586) is N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine is Cc1[nH]c2cncnc2c1CN(C)C.
What is the InChIKey of N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine?
The InChIKey is OIFJGTQGTDTOPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-7-8(5-14(2)3)10-9(13-7)4-11-6-12-10/h4,6,13H,5H2,1-3H3.
What are the key properties of N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine?
N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine has a molecular weight of 190.25 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methanamine is sourced from PubChem (CID 119084586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).