2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide

C15H31N3O2 — CID 65229319

IUPAC2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide
SMILESCCC(CN)C(=O)NCC(CC(C)C)N1CCOCC1
InChIInChI=1S/C15H31N3O2/c1-4-13(10-16)15(19)17-11-14(9-12(2)3)18-5-7-20-8-6-18/h12-14H,4-11,16H2,1-3H3,(H,17,19)
InChIKeyJXVXYQZGJNJMER-UHFFFAOYSA-N
MW285.43 g/mol
LogP0.83
Rot. Bonds8

About 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide

2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide (PubChem CID 65229319) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide
PubChem CID65229319
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC Name2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide
SMILESCCC(CN)C(=O)NCC(CC(C)C)N1CCOCC1
InChIInChI=1S/C15H31N3O2/c1-4-13(10-16)15(19)17-11-14(9-12(2)3)18-5-7-20-8-6-18/h12-14H,4-11,16H2,1-3H3,(H,17,19)
InChIKeyJXVXYQZGJNJMER-UHFFFAOYSA-N
XLogP0.83
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-(4-methyl-2-morpholin-4-ylpentyl)propanamide
CID 78968953
(2R)-2-amino-N-(4-methyl-2-morpholin-4-ylpentyl)pentanamide
CID 103813493
2-amino-4-methoxy-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide
CID 62477972
1-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)cyclopropane-1-carboxamide
CID 115453115
N-(4-methyl-2-morpholin-4-ylpentyl)morpholine-4-carboxamide
CID 110403300
2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 62491437
tert-butyl N-(4-methyl-2-morpholin-4-ylpentyl)carbamate
CID 63787814
5-amino-N-(4-methyl-2-morpholin-4-ylpentyl)hexanamide
CID 82849469
4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine
CID 43769799
1-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyrazole-4-carboxamide
CID 43050213
N-(4-methyl-2-morpholin-4-ylpentyl)-1H-pyrazole-4-carboxamide
CID 60786494
5-bromo-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 55521520

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide?
The IUPAC name of 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide (CID 65229319) is 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide?
The canonical SMILES for 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide is CCC(CN)C(=O)NCC(CC(C)C)N1CCOCC1.
What is the InChIKey of 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide?
The InChIKey is JXVXYQZGJNJMER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-4-13(10-16)15(19)17-11-14(9-12(2)3)18-5-7-20-8-6-18/h12-14H,4-11,16H2,1-3H3,(H,17,19).
What are the key properties of 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide?
2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide has a molecular weight of 285.43 g/mol, XLogP of 0.83, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide is sourced from PubChem (CID 65229319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).