3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine

C11H18N4 — CID 102985764

IUPAC3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine
SMILESCCCN(CC1CC1)c1nccnc1N
InChIInChI=1S/C11H18N4/c1-2-7-15(8-9-3-4-9)11-10(12)13-5-6-14-11/h5-6,9H,2-4,7-8H2,1H3,(H2,12,13)
InChIKeyMAKUDOCARRFURJ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.69
Rot. Bonds5

About 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine

3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine (PubChem CID 102985764) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine
PubChem CID102985764
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine
SMILESCCCN(CC1CC1)c1nccnc1N
InChIInChI=1S/C11H18N4/c1-2-7-15(8-9-3-4-9)11-10(12)13-5-6-14-11/h5-6,9H,2-4,7-8H2,1H3,(H2,12,13)
InChIKeyMAKUDOCARRFURJ-UHFFFAOYSA-N
XLogP1.69
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[cyclopropylmethyl(propyl)amino]pyrazine-2-carbothioamide
CID 55103092
3-(aminomethyl)-N-(cyclopropylmethyl)-N-propylpyridin-2-amine
CID 43587118
2-N-(cyclopropylmethyl)-2-N-propylpyrimidine-2,5-diamine
CID 61146606
3-bromo-2-N-(cyclopropylmethyl)-2-N-propylpyridine-2,5-diamine
CID 79531954
6-chloro-N-(cyclopropylmethyl)-5-methyl-N-propylpyrimidin-4-amine
CID 63729454
3-chloro-2-[cyclopropylmethyl(propyl)amino]pyridine-4-carbonitrile
CID 107057155
3-N-(4-ethylcyclohexyl)-3-N-methylpyrazine-2,3-diamine
CID 102986160
3-chloro-N-(cyclopropylmethyl)-N-ethylpyrazin-2-amine
CID 63956678
4-(aminomethyl)-N-(cyclopropylmethyl)-N-propylisoquinolin-1-amine
CID 106775573
3-[cyclopropylmethyl(propyl)amino]pyridazine-4-carboximidamide
CID 80513562
6-N-(cyclopropylmethyl)-6-N-propylpyridine-2,6-diamine
CID 80647313
4-N-(cyclopropylmethyl)-4-N-propyl-1H-pyrazole-4,5-diamine
CID 114988228

Frequently Asked Questions

What is the IUPAC name of 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine?
The IUPAC name of 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine (CID 102985764) is 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine.
What is the SMILES notation for 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine?
The canonical SMILES for 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine is CCCN(CC1CC1)c1nccnc1N.
What is the InChIKey of 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine?
The InChIKey is MAKUDOCARRFURJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-2-7-15(8-9-3-4-9)11-10(12)13-5-6-14-11/h5-6,9H,2-4,7-8H2,1H3,(H2,12,13).
What are the key properties of 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine?
3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(cyclopropylmethyl)-3-N-propylpyrazine-2,3-diamine is sourced from PubChem (CID 102985764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).