1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide

C17H23N3O3 — CID 119744203

IUPAC1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
SMILESCC1CN(C(=O)c2ccc(NC(=O)C3(N)CC3)cc2)CC(C)O1
InChIInChI=1S/C17H23N3O3/c1-11-9-20(10-12(2)23-11)15(21)13-3-5-14(6-4-13)19-16(22)17(18)7-8-17/h3-6,11-12H,7-10,18H2,1-2H3,(H,19,22)
InChIKeyUVEPICBOZOZMTD-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.37
Rot. Bonds3

About 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide

1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide (PubChem CID 119744203) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
PubChem CID119744203
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
SMILESCC1CN(C(=O)c2ccc(NC(=O)C3(N)CC3)cc2)CC(C)O1
InChIInChI=1S/C17H23N3O3/c1-11-9-20(10-12(2)23-11)15(21)13-3-5-14(6-4-13)19-16(22)17(18)7-8-17/h3-6,11-12H,7-10,18H2,1-2H3,(H,19,22)
InChIKeyUVEPICBOZOZMTD-UHFFFAOYSA-N
XLogP1.37
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[4-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 129466552
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
CID 42915501
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
2-[[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120975409
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119744220
(2,6-dimethylmorpholin-4-yl)-[4-(ethylamino)phenyl]methanone
CID 62170652
4-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]benzoic acid
CID 93051084
4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]benzoic acid
CID 93051085
2-(cyclopropylmethylamino)-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]acetamide
CID 119744229
(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone
CID 62170653
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119744232
2-(cyclopropylmethylamino)-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]acetamide;hydrochloride
CID 119744228

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide (CID 119744203) is 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide is CC1CN(C(=O)c2ccc(NC(=O)C3(N)CC3)cc2)CC(C)O1.
What is the InChIKey of 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
The InChIKey is UVEPICBOZOZMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-11-9-20(10-12(2)23-11)15(21)13-3-5-14(6-4-13)19-16(22)17(18)7-8-17/h3-6,11-12H,7-10,18H2,1-2H3,(H,19,22).
What are the key properties of 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 119744203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).