[6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol

C16H32N2O3 — CID 102936430

IUPAC[6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol
SMILESCC(C)NCC1(CN2CC(C)OC(CO)C2)CCCOC1
InChIInChI=1S/C16H32N2O3/c1-13(2)17-10-16(5-4-6-20-12-16)11-18-7-14(3)21-15(8-18)9-19/h13-15,17,19H,4-12H2,1-3H3
InChIKeyQKOWZKJARWGVPN-UHFFFAOYSA-N
MW300.44 g/mol
LogP0.86
Rot. Bonds6

About [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol

[6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol (PubChem CID 102936430) has the molecular formula C16H32N2O3 and a molecular weight of 300.44 g/mol. Its IUPAC name is [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol
PubChem CID102936430
Molecular FormulaC16H32N2O3
Molecular Weight300.44 g/mol
Exact Mass300.24
IUPAC Name[6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol
SMILESCC(C)NCC1(CN2CC(C)OC(CO)C2)CCCOC1
InChIInChI=1S/C16H32N2O3/c1-13(2)17-10-16(5-4-6-20-12-16)11-18-7-14(3)21-15(8-18)9-19/h13-15,17,19H,4-12H2,1-3H3
InChIKeyQKOWZKJARWGVPN-UHFFFAOYSA-N
XLogP0.86
TPSA53.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.44
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol with MolForge

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Related Compounds

[4-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-6-methylmorpholin-2-yl]methanol
CID 102936442
1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine
CID 63740106
N-[[3-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]oxan-3-yl]methyl]ethanamine
CID 104960751
[4-[[1-(hydroxymethyl)cycloheptyl]methyl]-6-methylmorpholin-2-yl]methanol
CID 102936478
N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine
CID 63740811
N-[[3-(azocan-1-ylmethyl)oxan-3-yl]methyl]propan-2-amine
CID 63740115
N-[[3-[(2-ethylmorpholin-4-yl)methyl]oxan-3-yl]methyl]propan-2-amine
CID 63740129
3-methyl-1-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]piperidin-4-ol
CID 114682063
N-[[3-[(3,4,5-trimethylpiperazin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 114539648
N-[[3-[(4-ethylpiperazin-1-yl)methyl]oxan-3-yl]methyl]propan-2-amine
CID 63742224
[1-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]piperidin-2-yl]methanol
CID 63740867
N-[[3-[(3,4-dimethylpyrrolidin-1-yl)methyl]oxan-3-yl]methyl]cyclopropanamine
CID 79184590

Frequently Asked Questions

What is the IUPAC name of [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol?
The IUPAC name of [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol (CID 102936430) is [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol?
The canonical SMILES for [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol is CC(C)NCC1(CN2CC(C)OC(CO)C2)CCCOC1.
What is the InChIKey of [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol?
The InChIKey is QKOWZKJARWGVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O3/c1-13(2)17-10-16(5-4-6-20-12-16)11-18-7-14(3)21-15(8-18)9-19/h13-15,17,19H,4-12H2,1-3H3.
What are the key properties of [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol?
[6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol has a molecular weight of 300.44 g/mol, XLogP of 0.86, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-4-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 102936430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).