4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine

C11H23ClN2O — CID 106121816

IUPAC4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine
SMILESCC(Cl)CCCNCCN1CCOCC1
InChIInChI=1S/C11H23ClN2O/c1-11(12)3-2-4-13-5-6-14-7-9-15-10-8-14/h11,13H,2-10H2,1H3
InChIKeyMQAHNHRNUPOGPG-UHFFFAOYSA-N
MW234.77 g/mol
LogP1.32
Rot. Bonds7

About 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine

4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine (PubChem CID 106121816) has the molecular formula C11H23ClN2O and a molecular weight of 234.77 g/mol. Its IUPAC name is 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine.

Molecular Properties

Compound Name4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine
PubChem CID106121816
Molecular FormulaC11H23ClN2O
Molecular Weight234.77 g/mol
Exact Mass234.15
IUPAC Name4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine
SMILESCC(Cl)CCCNCCN1CCOCC1
InChIInChI=1S/C11H23ClN2O/c1-11(12)3-2-4-13-5-6-14-7-9-15-10-8-14/h11,13H,2-10H2,1H3
InChIKeyMQAHNHRNUPOGPG-UHFFFAOYSA-N
XLogP1.32
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.77
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

4-methyl-N-(2-morpholin-4-ylethyl)pentan-1-amine
CID 61044634
4-chloro-N-(3-pyrrolidin-1-ylpropyl)pentan-1-amine
CID 106122021
2-methyl-N'-(2-morpholin-4-ylethyl)butane-1,4-diamine
CID 114987350
N',N'-dimethyl-N-(2-morpholin-4-ylethyl)propane-1,3-diamine
CID 28583738
1-(2-morpholin-4-ylethylamino)propan-2-ol
CID 43393555
4,4,4-trifluoro-N-(2-morpholin-4-ylethyl)butan-1-amine
CID 115513486
2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine
CID 64568943
N-[2-(azepan-1-yl)ethyl]-4-methylpentan-1-amine
CID 62575903
CID 59303713
CID 59303713
N-methyl-4-(2-morpholin-4-ylethylamino)butanamide
CID 63892681
5-morpholin-4-yl-N-propylpentan-1-amine
CID 62437718
N-(3-methylbutan-2-yl)-2-(2-morpholin-4-ylethylamino)acetamide
CID 60687185

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine?
The IUPAC name of 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine (CID 106121816) is 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine.
What is the SMILES notation for 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine?
The canonical SMILES for 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine is CC(Cl)CCCNCCN1CCOCC1.
What is the InChIKey of 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine?
The InChIKey is MQAHNHRNUPOGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23ClN2O/c1-11(12)3-2-4-13-5-6-14-7-9-15-10-8-14/h11,13H,2-10H2,1H3.
What are the key properties of 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine?
4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine has a molecular weight of 234.77 g/mol, XLogP of 1.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine is sourced from PubChem (CID 106121816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).