(2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide

C14H23N5O2 — CID 164532267

IUPAC(2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide
SMILESCCN(C(=O)[C@H](C)N1CCOCC1)c1cnc(N)c(N)c1
InChIInChI=1S/C14H23N5O2/c1-3-19(11-8-12(15)13(16)17-9-11)14(20)10(2)18-4-6-21-7-5-18/h8-10H,3-7,15H2,1-2H3,(H2,16,17)/t10-/m0/s1
InChIKeyRBMQQOPNWRQBRO-JTQLQIEISA-N
MW293.37 g/mol
LogP0.32
Rot. Bonds4

About (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide

(2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide (PubChem CID 164532267) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide.

Molecular Properties

Compound Name(2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide
PubChem CID164532267
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name(2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide
SMILESCCN(C(=O)[C@H](C)N1CCOCC1)c1cnc(N)c(N)c1
InChIInChI=1S/C14H23N5O2/c1-3-19(11-8-12(15)13(16)17-9-11)14(20)10(2)18-4-6-21-7-5-18/h8-10H,3-7,15H2,1-2H3,(H2,16,17)/t10-/m0/s1
InChIKeyRBMQQOPNWRQBRO-JTQLQIEISA-N
XLogP0.32
TPSA97.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-[4-(1-morpholin-4-yl-1-oxopropan-2-yl)piperazin-1-yl]-N-phenylpropanamide
CID 86904519
(2R)-N-[2-[(4aS,5aR)-5a-methyl-4,4a,5,6-tetrahydro-1H-cyclopropa[f]indazol-3-yl]-1H-imidazo[4,5-b]pyridin-6-yl]-N-ethyl-2-morpholin-4-ylpropanamide
CID 171431458
(2S)-N-ethyl-N-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 8595023
N-[(3-aminophenyl)methyl]-2-morpholin-4-ylpropanamide
CID 110483735
(2S)-N-ethyl-2-(4-hydroxypiperidin-1-yl)-N-phenylpropanamide
CID 94333132
1-[1-(N-ethylanilino)-1-oxopropan-2-yl]piperidine-4-carboxylic acid
CID 119906953
(2S)-N-ethyl-4-methyl-2-(morpholin-4-ylamino)-N-phenylpentanamide
CID 69222569
N-ethyl-2-[4-(1-hydroxybutan-2-yl)piperazin-1-yl]-N-phenylpropanamide
CID 111489569
N-ethyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-phenylpropanamide
CID 110881386
bis(2-morpholin-4-ylpropanamide);hydrate
CID 175797150
methyl (2R)-2-morpholin-4-ylpropanoate
CID 30030777
N-(2-amino-4-chlorophenyl)-2-morpholin-4-ylpropanamide
CID 16779290

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide?
The IUPAC name of (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide (CID 164532267) is (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide.
What is the SMILES notation for (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide?
The canonical SMILES for (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide is CCN(C(=O)[C@H](C)N1CCOCC1)c1cnc(N)c(N)c1.
What is the InChIKey of (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide?
The InChIKey is RBMQQOPNWRQBRO-JTQLQIEISA-N. The full InChI is InChI=1S/C14H23N5O2/c1-3-19(11-8-12(15)13(16)17-9-11)14(20)10(2)18-4-6-21-7-5-18/h8-10H,3-7,15H2,1-2H3,(H2,16,17)/t10-/m0/s1.
What are the key properties of (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide?
(2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide has a molecular weight of 293.37 g/mol, XLogP of 0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(5,6-diamino-3-pyridinyl)-N-ethyl-2-morpholin-4-ylpropanamide is sourced from PubChem (CID 164532267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).