4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide

C12H25N3O2 — CID 83106165

IUPAC4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
SMILESCC(C)NC(=O)C1COCCN1C(C)CCN
InChIInChI=1S/C12H25N3O2/c1-9(2)14-12(16)11-8-17-7-6-15(11)10(3)4-5-13/h9-11H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyBBDLYIKOVSZBTM-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.05
Rot. Bonds5

About 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide

4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide (PubChem CID 83106165) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
PubChem CID83106165
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
SMILESCC(C)NC(=O)C1COCCN1C(C)CCN
InChIInChI=1S/C12H25N3O2/c1-9(2)14-12(16)11-8-17-7-6-15(11)10(3)4-5-13/h9-11H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyBBDLYIKOVSZBTM-UHFFFAOYSA-N
XLogP-0.05
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(5-hydrazinyl-5-oxopentan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105965
(3S)-N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 140959044
N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 118118161
4-(1-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83106097
4-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105075
3-N-propan-2-ylmorpholine-3,4-dicarboxamide
CID 83106391
4-(1-aminopentan-3-yl)-N-methylmorpholine-3-carboxamide
CID 83106233
4-(4-amino-4-sulfanylidenebutan-2-yl)-N-methylmorpholine-3-carboxamide
CID 83099710
4-(1-aminopentan-3-yl)-N-ethylmorpholine-3-carboxamide
CID 83106656
4-[3-(ethylcarbamoyl)morpholin-4-yl]pentanoic acid
CID 83100771
N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide
CID 112573894
4-(5-hydrazinyl-5-oxopentan-2-yl)morpholine-3-carboxamide
CID 83095939

Frequently Asked Questions

What is the IUPAC name of 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The IUPAC name of 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide (CID 83106165) is 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide.
What is the SMILES notation for 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The canonical SMILES for 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide is CC(C)NC(=O)C1COCCN1C(C)CCN.
What is the InChIKey of 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The InChIKey is BBDLYIKOVSZBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-9(2)14-12(16)11-8-17-7-6-15(11)10(3)4-5-13/h9-11H,4-8,13H2,1-3H3,(H,14,16).
What are the key properties of 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide?
4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide has a molecular weight of 243.35 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide is sourced from PubChem (CID 83106165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).