4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide

C12H21N5O2 — CID 83101068

IUPAC4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide
SMILESCC(N)C(c1cnn(C)c1)N1CCOCC1C(N)=O
InChIInChI=1S/C12H21N5O2/c1-8(13)11(9-5-15-16(2)6-9)17-3-4-19-7-10(17)12(14)18/h5-6,8,10-11H,3-4,7,13H2,1-2H3,(H2,14,18)
InChIKeyYYRXEYBRWVHIGZ-UHFFFAOYSA-N
MW267.33 g/mol
LogP-1.01
Rot. Bonds4

About 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide

4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide (PubChem CID 83101068) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide
PubChem CID83101068
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide
SMILESCC(N)C(c1cnn(C)c1)N1CCOCC1C(N)=O
InChIInChI=1S/C12H21N5O2/c1-8(13)11(9-5-15-16(2)6-9)17-3-4-19-7-10(17)12(14)18/h5-6,8,10-11H,3-4,7,13H2,1-2H3,(H2,14,18)
InChIKeyYYRXEYBRWVHIGZ-UHFFFAOYSA-N
XLogP-1.01
TPSA99.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 5-1.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide
CID 83101539
4-[2-amino-1-(2-chlorophenyl)propyl]morpholine-3-carboxamide
CID 83101200
4-(2-amino-1-phenylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83097771
2-amino-1-(3-methylmorpholin-4-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 113279808
4-[2-amino-2-(4-methylphenyl)acetyl]morpholine-3-carboxamide
CID 106312666
4-(4-oxopentan-2-yl)morpholine-3-carboxamide
CID 83096571
4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
CID 83095626
4-[(1R)-1-naphthalen-1-ylethyl]morpholine-3-carboxamide
CID 140628038
4-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)morpholine-3-carboxamide
CID 83095756
1-(2-amino-1-phenylpropyl)pyrrolidine-2-carboxamide
CID 55017137
1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine
CID 83052284
4-(4-amino-1-methylpyrazol-3-yl)morpholine-3-carboxamide
CID 103078791

Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide?
The IUPAC name of 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide (CID 83101068) is 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide is CC(N)C(c1cnn(C)c1)N1CCOCC1C(N)=O.
What is the InChIKey of 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide?
The InChIKey is YYRXEYBRWVHIGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-8(13)11(9-5-15-16(2)6-9)17-3-4-19-7-10(17)12(14)18/h5-6,8,10-11H,3-4,7,13H2,1-2H3,(H2,14,18).
What are the key properties of 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide?
4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide has a molecular weight of 267.33 g/mol, XLogP of -1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide is sourced from PubChem (CID 83101068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).