5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine

C11H26N2O — CID 103387026

IUPAC5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine
SMILESCCCC(C)NC(CCCN)COC
InChIInChI=1S/C11H26N2O/c1-4-6-10(2)13-11(9-14-3)7-5-8-12/h10-11,13H,4-9,12H2,1-3H3
InChIKeySSCYTBBADGXPEJ-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.52
Rot. Bonds9

About 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine

5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine (PubChem CID 103387026) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine.

Molecular Properties

Compound Name5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine
PubChem CID103387026
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine
SMILESCCCC(C)NC(CCCN)COC
InChIInChI=1S/C11H26N2O/c1-4-6-10(2)13-11(9-14-3)7-5-8-12/h10-11,13H,4-9,12H2,1-3H3
InChIKeySSCYTBBADGXPEJ-UHFFFAOYSA-N
XLogP1.52
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(5-amino-1-methoxypentan-2-yl)amino]butan-1-ol
CID 103390783
5-methoxy-4-N-(3-methylpentan-2-yl)pentane-1,4-diamine
CID 103389536
5-methoxy-4-N-(1-morpholin-4-ylpropan-2-yl)pentane-1,4-diamine
CID 103387992
N-(1-methoxypropan-2-yl)pentan-2-amine
CID 43191929
1-[(5-amino-1-methoxypentan-2-yl)amino]pentan-2-ol
CID 103391070
N-(4-methoxybutan-2-yl)octan-4-amine
CID 103748088
N-(1-methoxypentan-2-yl)hex-5-en-2-amine
CID 104655717
4-N-[1-(1-adamantyl)ethyl]-5-methoxypentane-1,4-diamine
CID 103387014
2-[(5-amino-1-methoxypentan-2-yl)amino]-N,N-diethylpropanamide
CID 103388839
2-[(5-amino-1-methoxypentan-2-yl)amino]-3-methylbutanoic acid
CID 103389621
4-N-[1-(dimethylamino)-3-methylbutan-2-yl]-5-methoxypentane-1,4-diamine
CID 103389561
5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine
CID 103390275

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine?
The IUPAC name of 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine (CID 103387026) is 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine.
What is the SMILES notation for 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine?
The canonical SMILES for 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine is CCCC(C)NC(CCCN)COC.
What is the InChIKey of 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine?
The InChIKey is SSCYTBBADGXPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-4-6-10(2)13-11(9-14-3)7-5-8-12/h10-11,13H,4-9,12H2,1-3H3.
What are the key properties of 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine?
5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.52, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine is sourced from PubChem (CID 103387026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).