6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine

C14H22N4O2 — CID 123312240

IUPAC6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine
SMILESNc1cnc(N2CCOCC2)cc1NCC1CCCO1
InChIInChI=1S/C14H22N4O2/c15-12-10-17-14(18-3-6-19-7-4-18)8-13(12)16-9-11-2-1-5-20-11/h8,10-11H,1-7,9,15H2,(H,16,17)
InChIKeySVBXYDKQCCQYIZ-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.09
Rot. Bonds4

About 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine

6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine (PubChem CID 123312240) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine.

Molecular Properties

Compound Name6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine
PubChem CID123312240
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine
SMILESNc1cnc(N2CCOCC2)cc1NCC1CCCO1
InChIInChI=1S/C14H22N4O2/c15-12-10-17-14(18-3-6-19-7-4-18)8-13(12)16-9-11-2-1-5-20-11/h8,10-11H,1-7,9,15H2,(H,16,17)
InChIKeySVBXYDKQCCQYIZ-UHFFFAOYSA-N
XLogP1.09
TPSA72.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[(2S)-oxolan-2-yl]methyl]-6-piperidin-1-ylpyrimidin-4-amine
CID 138033732
6-morpholin-4-yl-4-N-(pyridin-3-ylmethyl)pyridine-3,4-diamine
CID 90161049
6-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 724881
6-N-(oxolan-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6,7-diamine
CID 43115518
4-morpholin-4-ylsulfonyl-1-N-(oxolan-2-ylmethyl)benzene-1,2-diamine
CID 4991638
2-N-(oxolan-2-ylmethyl)benzene-1,2-diamine
CID 43115525
5-[[4-(6-ethylpyrimidin-4-yl)piperazin-1-yl]methyl]-N-[[(2S)-oxolan-2-yl]methyl]pyrimidin-2-amine
CID 99948728
1-(6-morpholin-4-ylpyrimidin-4-yl)-N-[[(2S)-oxolan-2-yl]methyl]imidazole-4-carboxamide
CID 95102243
4-N,6-N-bis(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
CID 112857188
6-bromo-3-N-[[(2S)-oxetan-2-yl]methyl]pyridine-3,4-diamine
CID 167002967
3-amino-4-(oxan-2-ylmethylamino)benzoic acid
CID 55013425
morpholin-4-yl-[2-(oxolan-2-ylmethylamino)pyrimidin-5-yl]methanone
CID 109252032

Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine?
The IUPAC name of 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine (CID 123312240) is 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine.
What is the SMILES notation for 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine?
The canonical SMILES for 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine is Nc1cnc(N2CCOCC2)cc1NCC1CCCO1.
What is the InChIKey of 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine?
The InChIKey is SVBXYDKQCCQYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c15-12-10-17-14(18-3-6-19-7-4-18)8-13(12)16-9-11-2-1-5-20-11/h8,10-11H,1-7,9,15H2,(H,16,17).
What are the key properties of 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine?
6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine has a molecular weight of 278.36 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-4-N-(oxolan-2-ylmethyl)pyridine-3,4-diamine is sourced from PubChem (CID 123312240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).