N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide

C18H26N4O2 — CID 86996824

IUPACN-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide
SMILESCN(C)c1ccccc1NC(=O)C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C18H26N4O2/c1-21(2)16-6-4-3-5-15(16)20-18(24)17(23)19-13-9-11-22(12-10-13)14-7-8-14/h3-6,13-14H,7-12H2,1-2H3,(H,19,23)(H,20,24)
InChIKeyACBNRTBXQMNEMA-UHFFFAOYSA-N
MW330.43 g/mol
LogP1.43
Rot. Bonds4

About N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide

N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide (PubChem CID 86996824) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide
PubChem CID86996824
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide
SMILESCN(C)c1ccccc1NC(=O)C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C18H26N4O2/c1-21(2)16-6-4-3-5-15(16)20-18(24)17(23)19-13-9-11-22(12-10-13)14-7-8-14/h3-6,13-14H,7-12H2,1-2H3,(H,19,23)(H,20,24)
InChIKeyACBNRTBXQMNEMA-UHFFFAOYSA-N
XLogP1.43
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-N'-(2,3-difluorophenyl)oxamide
CID 95635039
N-cyclopropyl-N'-(2-hydroxyphenyl)oxamide
CID 108514360
methyl 2-[2-(dimethylamino)anilino]-2-oxoacetate
CID 106760603
N-cyclopentyl-N'-(2-methylphenyl)oxamide
CID 2290931
N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide
CID 39974888
N'-(5-chloro-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)oxamide
CID 142691779
N'-[2-(dimethylamino)phenyl]-N-(oxolan-2-ylmethyl)oxamide
CID 86995334
1-[(2-chlorophenyl)methyl]-3-(1-cyclopropylpiperidin-4-yl)-1-methylurea
CID 87003177
N-[2-(dimethylamino)phenyl]-1-methylsulfonylpiperidine-4-carboxamide
CID 30875404
2-(cyclopentylamino)-N-[2-(dimethylamino)phenyl]acetamide
CID 60849441
N-[2-[(1-cyclopropylpiperidin-4-yl)carbamoyl]phenyl]-N-methylthiophene-2-carboxamide
CID 55567595
1-(1-benzyl-2-oxo-3-pyridinyl)-3-(1-cyclopropylpiperidin-4-yl)urea
CID 71856012

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide (CID 86996824) is N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide is CN(C)c1ccccc1NC(=O)C(=O)NC1CCN(C2CC2)CC1.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide?
The InChIKey is ACBNRTBXQMNEMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-21(2)16-6-4-3-5-15(16)20-18(24)17(23)19-13-9-11-22(12-10-13)14-7-8-14/h3-6,13-14H,7-12H2,1-2H3,(H,19,23)(H,20,24).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide?
N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide has a molecular weight of 330.43 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-N'-[2-(dimethylamino)phenyl]oxamide is sourced from PubChem (CID 86996824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).