N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine

C15H26N4O — CID 107445126

IUPACN'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine
SMILESCC(C)(C)NCCNc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C15H26N4O/c1-15(2,3)18-7-6-16-13-4-5-14(17-12-13)19-8-10-20-11-9-19/h4-5,12,16,18H,6-11H2,1-3H3
InChIKeyVIDBQBADLLPMEF-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.72
Rot. Bonds5

About N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine

N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine (PubChem CID 107445126) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine
PubChem CID107445126
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine
SMILESCC(C)(C)NCCNc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C15H26N4O/c1-15(2,3)18-7-6-16-13-4-5-14(17-12-13)19-8-10-20-11-9-19/h4-5,12,16,18H,6-11H2,1-3H3
InChIKeyVIDBQBADLLPMEF-UHFFFAOYSA-N
XLogP1.72
TPSA49.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine with MolForge

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Related Compounds

N-butyl-6-morpholin-4-ylpyridin-3-amine
CID 43724794
N'-tert-butyl-N-(4-morpholin-4-ylphenyl)ethane-1,2-diamine
CID 107444694
6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine
CID 43724739
N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 43724722
2,2-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 11391397
N-benzyl-6-morpholin-4-ylpyridin-3-amine
CID 43724757
N-[(3-methylthiophen-2-yl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 43724746
N-(6-morpholin-4-yl-3-pyridinyl)ethanesulfonamide
CID 53016560
N-[(5-methylthiophen-2-yl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 43724710
N-(furan-3-ylmethyl)-6-morpholin-4-ylpyridin-3-amine
CID 63204595
N-(3-methoxy-2-methylpropyl)-6-morpholin-4-ylpyridin-3-amine
CID 116501035
6-morpholin-4-yl-N-(1-pyridin-4-ylethyl)pyridin-3-amine
CID 43724774

Frequently Asked Questions

What is the IUPAC name of N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine?
The IUPAC name of N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine (CID 107445126) is N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine.
What is the SMILES notation for N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine?
The canonical SMILES for N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine is CC(C)(C)NCCNc1ccc(N2CCOCC2)nc1.
What is the InChIKey of N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine?
The InChIKey is VIDBQBADLLPMEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-15(2,3)18-7-6-16-13-4-5-14(17-12-13)19-8-10-20-11-9-19/h4-5,12,16,18H,6-11H2,1-3H3.
What are the key properties of N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine?
N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine has a molecular weight of 278.40 g/mol, XLogP of 1.72, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine is sourced from PubChem (CID 107445126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).