4-N,4-N-diethyl-5-methoxypentane-1,4-diamine

C10H24N2O — CID 103391611

IUPAC4-N,4-N-diethyl-5-methoxypentane-1,4-diamine
SMILESCCN(CC)C(CCCN)COC
InChIInChI=1S/C10H24N2O/c1-4-12(5-2)10(9-13-3)7-6-8-11/h10H,4-9,11H2,1-3H3
InChIKeyCCUDMYLSEWEOGL-UHFFFAOYSA-N
MW188.31 g/mol
LogP1.08
Rot. Bonds8

About 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine

4-N,4-N-diethyl-5-methoxypentane-1,4-diamine (PubChem CID 103391611) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine.

Molecular Properties

Compound Name4-N,4-N-diethyl-5-methoxypentane-1,4-diamine
PubChem CID103391611
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name4-N,4-N-diethyl-5-methoxypentane-1,4-diamine
SMILESCCN(CC)C(CCCN)COC
InChIInChI=1S/C10H24N2O/c1-4-12(5-2)10(9-13-3)7-6-8-11/h10H,4-9,11H2,1-3H3
InChIKeyCCUDMYLSEWEOGL-UHFFFAOYSA-N
XLogP1.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(cyclobutylmethyl)-4-N-ethyl-5-methoxypentane-1,4-diamine
CID 107402945
4-N-ethyl-4-N-(furan-2-ylmethyl)-5-methoxypentane-1,4-diamine
CID 103391763
4-N-ethyl-4-N-(2-methoxyethyl)pentane-1,4-diamine
CID 62436479
5-methoxy-4-N-methyl-4-N-pentan-2-ylpentane-1,4-diamine
CID 103391711
5-methoxy-4-N-(2-methoxyethyl)-4-N-methylpentane-1,4-diamine
CID 103391769
4-N-benzyl-5-methoxy-4-N-propylpentane-1,4-diamine
CID 103391726
2-[(5-amino-1-methoxypentan-2-yl)-(2,2,2-trifluoroethyl)amino]ethanol
CID 107494968
2-[(5-amino-1-methoxypentan-2-yl)-methylamino]acetamide
CID 103391695
4-[(5-amino-1-methoxypentan-2-yl)-methylamino]butan-2-ol
CID 103392024
5-methoxy-4-N-propan-2-yl-4-N-(2,2,2-trifluoroethyl)pentane-1,4-diamine
CID 103391840
5-methoxy-4-N-methyl-4-N-[(2-methylcyclopropyl)methyl]pentane-1,4-diamine
CID 103391921
2-N-ethyl-2-N-(2-methoxyethyl)octane-1,2-diamine
CID 61448149

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine?
The IUPAC name of 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine (CID 103391611) is 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine.
What is the SMILES notation for 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine?
The canonical SMILES for 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine is CCN(CC)C(CCCN)COC.
What is the InChIKey of 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine?
The InChIKey is CCUDMYLSEWEOGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-4-12(5-2)10(9-13-3)7-6-8-11/h10H,4-9,11H2,1-3H3.
What are the key properties of 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine?
4-N,4-N-diethyl-5-methoxypentane-1,4-diamine has a molecular weight of 188.31 g/mol, XLogP of 1.08, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-diethyl-5-methoxypentane-1,4-diamine is sourced from PubChem (CID 103391611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).