N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide

C12H17N5O4 — CID 4190492

IUPACN-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
SMILESO=C(NC(CO)C(=O)NN1CCOCC1)c1cnccn1
InChIInChI=1S/C12H17N5O4/c18-8-10(12(20)16-17-3-5-21-6-4-17)15-11(19)9-7-13-1-2-14-9/h1-2,7,10,18H,3-6,8H2,(H,15,19)(H,16,20)
InChIKeyKZZJEROZGZCQPH-UHFFFAOYSA-N
MW295.30 g/mol
LogP-2.07
Rot. Bonds5

About N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide

N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide (PubChem CID 4190492) has the molecular formula C12H17N5O4 and a molecular weight of 295.30 g/mol. Its IUPAC name is N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
PubChem CID4190492
Molecular FormulaC12H17N5O4
Molecular Weight295.30 g/mol
Exact Mass295.13
IUPAC NameN-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
SMILESO=C(NC(CO)C(=O)NN1CCOCC1)c1cnccn1
InChIInChI=1S/C12H17N5O4/c18-8-10(12(20)16-17-3-5-21-6-4-17)15-11(19)9-7-13-1-2-14-9/h1-2,7,10,18H,3-6,8H2,(H,15,19)(H,16,20)
InChIKeyKZZJEROZGZCQPH-UHFFFAOYSA-N
XLogP-2.07
TPSA116.68 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 5-2.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]quinoxaline-2-carboxamide
CID 3494740
(2S)-3-hydroxy-N-morpholin-4-yl-2-[(2-pyridin-4-ylacetyl)amino]propanamide
CID 6724742
[[(2R)-4-morpholin-4-yl-4-oxo-2-(pyrazine-2-carbonylamino)butanoyl]amino]methylboronic acid
CID 168919748
N-(2-morpholin-4-yl-2-oxoethyl)pyrazine-2-carboxamide
CID 110741937
N-[(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-3-hydroxy-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 6724640
N-[(2S)-3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]-4-[4-(trifluoromethyl)phenyl]benzamide
CID 6723634
N-[1-[[(3R)-2-hydroxyoxaborolan-3-yl]amino]-4-morpholin-4-yl-1,4-dioxobutan-2-yl]pyrazine-2-carboxamide
CID 174051837
N-[(2S)-1-[(4-chlorophenyl)methylamino]-3-hydroxy-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 6724624
3-hydroxy-N-morpholin-4-yl-2-(2-phenylpropanoylamino)propanamide
CID 4253359
N-[(2S)-1-morpholin-4-yl-3-phenylpropan-2-yl]pyrazine-2-carboxamide
CID 96515929
(2S)-4-hydroxy-2-(pyrazine-2-carbonylamino)butanoic acid
CID 107822419
(2S)-2-(pyrazine-2-carbonylamino)butanedioic acid
CID 112733139

Frequently Asked Questions

What is the IUPAC name of N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
The IUPAC name of N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide (CID 4190492) is N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide is O=C(NC(CO)C(=O)NN1CCOCC1)c1cnccn1.
What is the InChIKey of N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
The InChIKey is KZZJEROZGZCQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O4/c18-8-10(12(20)16-17-3-5-21-6-4-17)15-11(19)9-7-13-1-2-14-9/h1-2,7,10,18H,3-6,8H2,(H,15,19)(H,16,20).
What are the key properties of N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide has a molecular weight of 295.30 g/mol, XLogP of -2.07, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 4190492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).