N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide

C19H25N5O2 — CID 3234913

IUPACN,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide
SMILESCN(C)C(=O)c1ccc(-c2cncnc2NCCN2CCOCC2)cc1
InChIInChI=1S/C19H25N5O2/c1-23(2)19(25)16-5-3-15(4-6-16)17-13-20-14-22-18(17)21-7-8-24-9-11-26-12-10-24/h3-6,13-14H,7-12H2,1-2H3,(H,20,21,22)
InChIKeyZQBBLSOSNHOYKJ-UHFFFAOYSA-N
MW355.44 g/mol
LogP1.59
Rot. Bonds6

About N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide

N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide (PubChem CID 3234913) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide
PubChem CID3234913
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide
SMILESCN(C)C(=O)c1ccc(-c2cncnc2NCCN2CCOCC2)cc1
InChIInChI=1S/C19H25N5O2/c1-23(2)19(25)16-5-3-15(4-6-16)17-13-20-14-22-18(17)21-7-8-24-9-11-26-12-10-24/h3-6,13-14H,7-12H2,1-2H3,(H,20,21,22)
InChIKeyZQBBLSOSNHOYKJ-UHFFFAOYSA-N
XLogP1.59
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-dimethyl-4-(morpholin-4-ylmethyl)benzamide
CID 43918660
N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109153848
N,N-dimethyl-4-[3-(2-morpholin-4-ylethoxy)naphthalen-1-yl]benzamide
CID 172655306
N-[3-(dimethylamino)propyl]-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109153978
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
5-bromo-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 66341208
1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 19262651
1-[4-[[6-(2-morpholin-4-ylethylamino)-5-nitropyrimidin-4-yl]amino]phenyl]ethanone
CID 22533671
N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide
CID 109229643
6-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109154098
4-methoxy-N-methyl-3-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]benzamide
CID 72919032
6-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 3232787

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide?
The IUPAC name of N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide (CID 3234913) is N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide is CN(C)C(=O)c1ccc(-c2cncnc2NCCN2CCOCC2)cc1.
What is the InChIKey of N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide?
The InChIKey is ZQBBLSOSNHOYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-23(2)19(25)16-5-3-15(4-6-16)17-13-20-14-22-18(17)21-7-8-24-9-11-26-12-10-24/h3-6,13-14H,7-12H2,1-2H3,(H,20,21,22).
What are the key properties of N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide?
N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide has a molecular weight of 355.44 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[4-(2-morpholin-4-ylethylamino)pyrimidin-5-yl]benzamide is sourced from PubChem (CID 3234913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).