2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine

C18H30N4O2 — CID 75478549

IUPAC2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine
SMILESCN(CC1CCOCC1)c1nccnc1N(C)CC1CCOCC1
InChIInChI=1S/C18H30N4O2/c1-21(13-15-3-9-23-10-4-15)17-18(20-8-7-19-17)22(2)14-16-5-11-24-12-6-16/h7-8,15-16H,3-6,9-14H2,1-2H3
InChIKeyWQQLJXSHDKBSGX-UHFFFAOYSA-N
MW334.46 g/mol
LogP2.20
Rot. Bonds6

About 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine

2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine (PubChem CID 75478549) has the molecular formula C18H30N4O2 and a molecular weight of 334.46 g/mol. Its IUPAC name is 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine
PubChem CID75478549
Molecular FormulaC18H30N4O2
Molecular Weight334.46 g/mol
Exact Mass334.24
IUPAC Name2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine
SMILESCN(CC1CCOCC1)c1nccnc1N(C)CC1CCOCC1
InChIInChI=1S/C18H30N4O2/c1-21(13-15-3-9-23-10-4-15)17-18(20-8-7-19-17)22(2)14-16-5-11-24-12-6-16/h7-8,15-16H,3-6,9-14H2,1-2H3
InChIKeyWQQLJXSHDKBSGX-UHFFFAOYSA-N
XLogP2.20
TPSA50.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-(aminomethyl)-3-chloro-N-methyl-N-(oxan-4-ylmethyl)pyridin-2-amine
CID 107055559
4-N,5-dimethyl-4-N-(oxan-4-ylmethyl)pyrimidine-4,6-diamine
CID 80845882
N-methyl-N-(oxolan-3-ylmethyl)-3-propan-2-yloxypyrazin-2-amine
CID 133455194
5-chloro-4-[methyl(oxan-4-ylmethyl)amino]-1H-pyrimidin-6-one
CID 137009662
5-methyl-6-[methyl(oxan-4-ylmethyl)amino]pyridine-3-carbaldehyde
CID 80631209
2-[methyl(oxolan-3-ylmethyl)amino]pyridine-3-carbonitrile
CID 71862352
2-N,4-N-dimethyl-4-N-(oxan-4-ylmethyl)pyridine-2,4-diamine
CID 113367846
3-(aminomethyl)-N-methyl-N-(oxan-3-ylmethyl)pyrazin-2-amine
CID 63727442
[2-[methyl(oxan-4-ylmethyl)amino]-4-pyridinyl]methanol
CID 63711407
2-N,6-N-dimethyl-6-N-(oxan-4-ylmethyl)-7H-purine-2,6-diamine
CID 114785237
6-hydrazinyl-N-methyl-N-(oxan-4-ylmethyl)-5-propylpyrimidin-4-amine
CID 80910226
3-N-(cyclohex-3-en-1-ylmethyl)-2-N,2-N,3-N-trimethylpyrazine-2,3-diamine
CID 133475752

Frequently Asked Questions

What is the IUPAC name of 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine?
The IUPAC name of 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine (CID 75478549) is 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine.
What is the SMILES notation for 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine?
The canonical SMILES for 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine is CN(CC1CCOCC1)c1nccnc1N(C)CC1CCOCC1.
What is the InChIKey of 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine?
The InChIKey is WQQLJXSHDKBSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O2/c1-21(13-15-3-9-23-10-4-15)17-18(20-8-7-19-17)22(2)14-16-5-11-24-12-6-16/h7-8,15-16H,3-6,9-14H2,1-2H3.
What are the key properties of 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine?
2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine has a molecular weight of 334.46 g/mol, XLogP of 2.20, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N-dimethyl-2-N,3-N-bis(oxan-4-ylmethyl)pyrazine-2,3-diamine is sourced from PubChem (CID 75478549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).