N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide

C12H15N3O2 — CID 43699902

IUPACN-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide
SMILESC=CC(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C12H15N3O2/c1-2-12(16)14-10-3-4-11(13-9-10)15-5-7-17-8-6-15/h2-4,9H,1,5-8H2,(H,14,16)
InChIKeyLHAYQUXWFIHSAB-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.04
Rot. Bonds3

About N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide

N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide (PubChem CID 43699902) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide.

Molecular Properties

Compound NameN-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide
PubChem CID43699902
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC NameN-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide
SMILESC=CC(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C12H15N3O2/c1-2-12(16)14-10-3-4-11(13-9-10)15-5-7-17-8-6-15/h2-4,9H,1,5-8H2,(H,14,16)
InChIKeyLHAYQUXWFIHSAB-UHFFFAOYSA-N
XLogP1.04
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47162241
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953
2,2-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 11391397
4-[(6-morpholin-4-yl-3-pyridinyl)amino]-4-oxobutanoic acid
CID 39180266
(2S)-2-amino-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)butanamide
CID 61180630
(E)-3-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]-N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide
CID 34444534
N-[3-[4-amino-2-[(6-morpholin-4-yl-3-pyridinyl)amino]quinazolin-8-yl]phenyl]prop-2-enamide
CID 118162922
2-[2-[(6-morpholin-4-yl-3-pyridinyl)amino]-2-oxoethoxy]acetic acid
CID 61329220
2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 119946355
(E)-3-(3-methoxyphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide
CID 28923789
2-(3,4-dichlorophenyl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 17453496
N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
CID 3975213

Frequently Asked Questions

What is the IUPAC name of N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide?
The IUPAC name of N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide (CID 43699902) is N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide.
What is the SMILES notation for N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide?
The canonical SMILES for N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide is C=CC(=O)Nc1ccc(N2CCOCC2)nc1.
What is the InChIKey of N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide?
The InChIKey is LHAYQUXWFIHSAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-2-12(16)14-10-3-4-11(13-9-10)15-5-7-17-8-6-15/h2-4,9H,1,5-8H2,(H,14,16).
What are the key properties of N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide?
N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide has a molecular weight of 233.27 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide is sourced from PubChem (CID 43699902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).