2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate

C18H30N4O4 — CID 143341161

IUPAC2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate
SMILESCCCN(CCC)c1cc(N)nc(OCCOC(=O)N2CCOCC2)c1
InChIInChI=1S/C18H30N4O4/c1-3-5-21(6-4-2)15-13-16(19)20-17(14-15)25-11-12-26-18(23)22-7-9-24-10-8-22/h13-14H,3-12H2,1-2H3,(H2,19,20)
InChIKeyXHNRWCTWBGTHIS-UHFFFAOYSA-N
MW366.46 g/mol
LogP2.14
Rot. Bonds9

About 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate

2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate (PubChem CID 143341161) has the molecular formula C18H30N4O4 and a molecular weight of 366.46 g/mol. Its IUPAC name is 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate.

Molecular Properties

Compound Name2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate
PubChem CID143341161
Molecular FormulaC18H30N4O4
Molecular Weight366.46 g/mol
Exact Mass366.23
IUPAC Name2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate
SMILESCCCN(CCC)c1cc(N)nc(OCCOC(=O)N2CCOCC2)c1
InChIInChI=1S/C18H30N4O4/c1-3-5-21(6-4-2)15-13-16(19)20-17(14-15)25-11-12-26-18(23)22-7-9-24-10-8-22/h13-14H,3-12H2,1-2H3,(H2,19,20)
InChIKeyXHNRWCTWBGTHIS-UHFFFAOYSA-N
XLogP2.14
TPSA90.15 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

ethane;molecular hydrogen;6-(2-morpholin-4-ylethoxy)-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143340801
1-[2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl]pyrrolidine-2,5-dione
CID 143341116
6-ethoxy-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143340794
4-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]-N-cyclohexylbutanamide
CID 143340832
N-[6-amino-4-[butyl(propyl)amino]-2-pyridinyl]-2-morpholin-4-ylacetamide
CID 143341527
ethane;2-methanimidoyl-4-methylaniline;6-(2-morpholin-4-ylethoxy)-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143341673
ethane;3-methanimidoyl-N-methylaniline;6-(2-morpholin-4-ylethoxy)-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143341036
ethane;6-N-methyl-6-N-(2-morpholin-4-ylethyl)-4-N,4-N-dipropylpyridine-2,4,6-triamine
CID 143533372
1-[4-[2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl]-2-[(Z)-2-aminoethenyl]-3-methylpyrrol-1-yl]ethanone
CID 143450200
6-[2-(cyclohexylamino)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine;ethane
CID 143846965
4-[(dipropylamino)methyl]-6-(2-morpholin-4-ylethoxy)pyridin-2-amine
CID 143533609
3-[(2E)-2-[[4-(dipropylamino)-6-(2-morpholin-4-ylethoxy)-2-pyridinyl]methylidene]hydrazinyl]benzamide
CID 89163631

Frequently Asked Questions

What is the IUPAC name of 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate?
The IUPAC name of 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate (CID 143341161) is 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate.
What is the SMILES notation for 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate?
The canonical SMILES for 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate is CCCN(CCC)c1cc(N)nc(OCCOC(=O)N2CCOCC2)c1.
What is the InChIKey of 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate?
The InChIKey is XHNRWCTWBGTHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O4/c1-3-5-21(6-4-2)15-13-16(19)20-17(14-15)25-11-12-26-18(23)22-7-9-24-10-8-22/h13-14H,3-12H2,1-2H3,(H2,19,20).
What are the key properties of 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate?
2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate has a molecular weight of 366.46 g/mol, XLogP of 2.14, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-amino-4-(dipropylamino)-2-pyridinyl]oxy]ethyl morpholine-4-carboxylate is sourced from PubChem (CID 143341161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).