5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine

C13H29N3O2 — CID 103387992

IUPAC5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine
SMILESCOCC(CCCN)NC(C)CN1CCOCC1
InChIInChI=1S/C13H29N3O2/c1-12(10-16-6-8-18-9-7-16)15-13(11-17-2)4-3-5-14/h12-13,15H,3-11,14H2,1-2H3
InChIKeyRPSRAQOMZOXZGU-UHFFFAOYSA-N
MW259.39 g/mol
LogP0.05
Rot. Bonds9

About 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine

5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine (PubChem CID 103387992) has the molecular formula C13H29N3O2 and a molecular weight of 259.39 g/mol. Its IUPAC name is 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine.

Molecular Properties

Compound Name5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine
PubChem CID103387992
Molecular FormulaC13H29N3O2
Molecular Weight259.39 g/mol
Exact Mass259.23
IUPAC Name5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine
SMILESCOCC(CCCN)NC(C)CN1CCOCC1
InChIInChI=1S/C13H29N3O2/c1-12(10-16-6-8-18-9-7-16)15-13(11-17-2)4-3-5-14/h12-13,15H,3-11,14H2,1-2H3
InChIKeyRPSRAQOMZOXZGU-UHFFFAOYSA-N
XLogP0.05
TPSA59.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine
CID 103387026
3-[(5-amino-1-methoxypentan-2-yl)amino]butan-1-ol
CID 103390783
3-methoxy-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)propan-1-amine
CID 116500887
2,6-dimethyl-N-(1-morpholin-4-ylpropan-2-yl)heptan-4-amine
CID 43675652
5-methoxy-4-N-(oxan-4-yl)pentane-1,4-diamine
CID 103387909
5-methoxy-4-N-(3-methylpentan-2-yl)pentane-1,4-diamine
CID 103389536
4-[(4S)-6-methoxy-4-methylhexyl]morpholine
CID 174809436
ethane;1-methoxybutane;4-(2-methylpropyl)morpholine
CID 163400303
N-(3-fluoropropyl)-1-morpholin-4-ylpropan-2-amine
CID 81105734
N-(2,2-dimethoxyethyl)-1-morpholin-4-ylpropan-2-amine
CID 63684989
4-methoxy-2-(morpholin-4-ylmethyl)butan-1-ol
CID 117236832
1-(4-methoxybutan-2-ylamino)-3-morpholin-4-ylpropan-2-ol
CID 64604856

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine?
The IUPAC name of 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine (CID 103387992) is 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine.
What is the SMILES notation for 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine?
The canonical SMILES for 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine is COCC(CCCN)NC(C)CN1CCOCC1.
What is the InChIKey of 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine?
The InChIKey is RPSRAQOMZOXZGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O2/c1-12(10-16-6-8-18-9-7-16)15-13(11-17-2)4-3-5-14/h12-13,15H,3-11,14H2,1-2H3.
What are the key properties of 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine?
5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine has a molecular weight of 259.39 g/mol, XLogP of 0.05, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine is sourced from PubChem (CID 103387992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).