4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine

C14H30N2O2 — CID 115295435

IUPAC4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine
SMILESCCC(CC)N(CCOC)CC1(N)CCOCC1
InChIInChI=1S/C14H30N2O2/c1-4-13(5-2)16(8-11-17-3)12-14(15)6-9-18-10-7-14/h13H,4-12,15H2,1-3H3
InChIKeyGFNWOXRZLAJAHX-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.63
Rot. Bonds8

About 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine

4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine (PubChem CID 115295435) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine.

Molecular Properties

Compound Name4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine
PubChem CID115295435
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine
SMILESCCC(CC)N(CCOC)CC1(N)CCOCC1
InChIInChI=1S/C14H30N2O2/c1-4-13(5-2)16(8-11-17-3)12-14(15)6-9-18-10-7-14/h13H,4-12,15H2,1-3H3
InChIKeyGFNWOXRZLAJAHX-UHFFFAOYSA-N
XLogP1.63
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[2-methoxyethyl(pentan-3-yl)amino]methyl]cyclobutan-1-amine
CID 81171241
N-[[4-(aminomethyl)oxan-4-yl]methyl]-N-(2-methoxyethyl)pentan-3-amine
CID 62390646
4-[[1-cyclopropylethyl(2-methoxyethyl)amino]methyl]oxan-4-amine
CID 113280948
4-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]oxan-4-amine
CID 115295426
4-[[2-methoxyethyl(prop-2-enyl)amino]methyl]oxan-4-amine
CID 103339286
1-[[2-methoxyethyl(pentan-3-yl)amino]methyl]cyclopentan-1-ol
CID 65212569
3-[[bis(2-methoxyethyl)amino]methyl]oxolan-3-amine
CID 64893649
4-(2-methoxyethyl)oxan-4-amine
CID 63220638
3-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxane-3-carbaldehyde
CID 63741331
3-[[2-methoxyethyl(methyl)amino]methyl]oxolan-3-amine
CID 64893461
N-[[3-(ethylaminomethyl)oxan-3-yl]methyl]-N-(2-methoxyethyl)pentan-3-amine
CID 63739653
2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine
CID 82767668

Frequently Asked Questions

What is the IUPAC name of 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine?
The IUPAC name of 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine (CID 115295435) is 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine.
What is the SMILES notation for 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine?
The canonical SMILES for 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine is CCC(CC)N(CCOC)CC1(N)CCOCC1.
What is the InChIKey of 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine?
The InChIKey is GFNWOXRZLAJAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-4-13(5-2)16(8-11-17-3)12-14(15)6-9-18-10-7-14/h13H,4-12,15H2,1-3H3.
What are the key properties of 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine?
4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine has a molecular weight of 258.41 g/mol, XLogP of 1.63, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]oxan-4-amine is sourced from PubChem (CID 115295435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).