N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide

C13H21N5O2 — CID 110268136

IUPACN-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide
SMILESCN(C)CCNC(=O)C1CN(c2ncccn2)CCO1
InChIInChI=1S/C13H21N5O2/c1-17(2)7-6-14-12(19)11-10-18(8-9-20-11)13-15-4-3-5-16-13/h3-5,11H,6-10H2,1-2H3,(H,14,19)
InChIKeyQUTZXVVZHDRVOR-UHFFFAOYSA-N
MW279.34 g/mol
LogP-0.64
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide

N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide (PubChem CID 110268136) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide
PubChem CID110268136
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC NameN-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide
SMILESCN(C)CCNC(=O)C1CN(c2ncccn2)CCO1
InChIInChI=1S/C13H21N5O2/c1-17(2)7-6-14-12(19)11-10-18(8-9-20-11)13-15-4-3-5-16-13/h3-5,11H,6-10H2,1-2H3,(H,14,19)
InChIKeyQUTZXVVZHDRVOR-UHFFFAOYSA-N
XLogP-0.64
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 5-0.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-N-[3-(3-methoxyphenyl)propyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide
CID 92632963
(2R)-N-(oxan-4-yl)-4-pyrimidin-2-ylmorpholine-2-carboxamide
CID 95813092
N-[2-(dimethylamino)ethyl]-3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 108943839
N-[2-(4-methoxyphenoxy)ethyl]-N-methyl-4-pyrimidin-2-ylmorpholine-2-carboxamide
CID 110246447
(2S)-N-[2-(dimethylamino)ethyl]-4-[[1-(2-fluorophenyl)pyrazol-4-yl]methyl]morpholine-2-carboxamide
CID 95895704
(2R)-N-methyl-4-(4-methylpyrimidin-2-yl)morpholine-2-carboxamide
CID 97348797
N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide
CID 163352589
N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide
CID 84576380
N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 109300337
(2S,3aR,7aS)-N-(2-methoxyethyl)-6-pyrimidin-2-yl-3,3a,4,5,7,7a-hexahydro-2H-furo[2,3-c]pyridine-2-carboxamide
CID 124789049
4-ethyl-N-[2-(methylamino)ethyl]morpholine-2-carboxamide
CID 119502673
N-[2-[[N-methyl-C-(4-pyrimidin-2-ylpiperazin-1-yl)carbonimidoyl]amino]ethyl]cyclopropanecarboxamide
CID 111206186

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide (CID 110268136) is N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide is CN(C)CCNC(=O)C1CN(c2ncccn2)CCO1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide?
The InChIKey is QUTZXVVZHDRVOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-17(2)7-6-14-12(19)11-10-18(8-9-20-11)13-15-4-3-5-16-13/h3-5,11H,6-10H2,1-2H3,(H,14,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide?
N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide has a molecular weight of 279.34 g/mol, XLogP of -0.64, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide is sourced from PubChem (CID 110268136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).