N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine

C12H22N4 — CID 131659176

IUPACN,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine
SMILESCC(C)N1Cc2cncn2C(CN(C)C)C1
InChIInChI=1S/C12H22N4/c1-10(2)15-7-11-5-13-9-16(11)12(8-15)6-14(3)4/h5,9-10,12H,6-8H2,1-4H3
InChIKeyONKJSZPMQAYKCX-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.21
Rot. Bonds3

About N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine

N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine (PubChem CID 131659176) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine
PubChem CID131659176
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine
SMILESCC(C)N1Cc2cncn2C(CN(C)C)C1
InChIInChI=1S/C12H22N4/c1-10(2)15-7-11-5-13-9-16(11)12(8-15)6-14(3)4/h5,9-10,12H,6-8H2,1-4H3
InChIKeyONKJSZPMQAYKCX-UHFFFAOYSA-N
XLogP1.21
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine (CID 131659176) is N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine is CC(C)N1Cc2cncn2C(CN(C)C)C1.
What is the InChIKey of N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine?
The InChIKey is ONKJSZPMQAYKCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-10(2)15-7-11-5-13-9-16(11)12(8-15)6-14(3)4/h5,9-10,12H,6-8H2,1-4H3.
What are the key properties of N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine?
N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine has a molecular weight of 222.34 g/mol, XLogP of 1.21, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanamine is sourced from PubChem (CID 131659176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).