N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine

C14H23N3O — CID 83122279

IUPACN-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine
SMILESCCCNC(C)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C14H23N3O/c1-3-6-15-12(2)14-5-4-13(11-16-14)17-7-9-18-10-8-17/h4-5,11-12,15H,3,6-10H2,1-2H3
InChIKeyVDRXNXANKFBDQF-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.98
Rot. Bonds5

About N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine

N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine (PubChem CID 83122279) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine
PubChem CID83122279
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine
SMILESCCCNC(C)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C14H23N3O/c1-3-6-15-12(2)14-5-4-13(11-16-14)17-7-9-18-10-8-17/h4-5,11-12,15H,3,6-10H2,1-2H3
InChIKeyVDRXNXANKFBDQF-UHFFFAOYSA-N
XLogP1.98
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(5-morpholin-4-yl-2-pyridinyl)ethanamine
CID 83122280
N-[1-[5-(4-methoxypiperidin-1-yl)-2-pyridinyl]ethyl]propan-1-amine
CID 83122477
N-[1-[5-(2-methyl-1,4-oxazepan-4-yl)-2-pyridinyl]ethyl]propan-1-amine
CID 83123117
N-methylpropan-2-amine;4-(6-propan-2-yl-3-pyridinyl)morpholine
CID 156652466
4-[6-(1-ethoxyethyl)-3-pyridinyl]morpholine
CID 134477880
N-[1-[5-(3,4-dimethoxypyrrolidin-1-yl)-2-pyridinyl]ethyl]propan-1-amine
CID 103534521
propan-2-amine;4-(6-propan-2-yl-3-pyridinyl)morpholine
CID 172576033
N-[1-[5-(3-methoxypiperidin-1-yl)-2-pyridinyl]ethyl]propan-1-amine
CID 102959079
1-[5-(1,4-oxazepan-4-yl)-2-pyridinyl]propan-1-ol
CID 112585414
1-[6-[1-(ethylamino)ethyl]-3-pyridinyl]piperidin-4-ol
CID 83122376
N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine
CID 83131415
1-[5-(4-tert-butylpiperazin-1-yl)-2-pyridinyl]-N-ethylethanamine
CID 83111380

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine (CID 83122279) is N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine is CCCNC(C)c1ccc(N2CCOCC2)cn1.
What is the InChIKey of N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine?
The InChIKey is VDRXNXANKFBDQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-6-15-12(2)14-5-4-13(11-16-14)17-7-9-18-10-8-17/h4-5,11-12,15H,3,6-10H2,1-2H3.
What are the key properties of N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine?
N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine has a molecular weight of 249.36 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-morpholin-4-yl-2-pyridinyl)ethyl]propan-1-amine is sourced from PubChem (CID 83122279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).