4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide

C15H31N3O2 — CID 66432044

IUPAC4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide
SMILESCCC1COC(C)CN1C(CN)CC(=O)NC(C)(C)C
InChIInChI=1S/C15H31N3O2/c1-6-12-10-20-11(2)9-18(12)13(8-16)7-14(19)17-15(3,4)5/h11-13H,6-10,16H2,1-5H3,(H,17,19)
InChIKeyQGCQNSGNWWIZSA-UHFFFAOYSA-N
MW285.43 g/mol
LogP1.12
Rot. Bonds5

About 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide

4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide (PubChem CID 66432044) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide.

Molecular Properties

Compound Name4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide
PubChem CID66432044
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC Name4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide
SMILESCCC1COC(C)CN1C(CN)CC(=O)NC(C)(C)C
InChIInChI=1S/C15H31N3O2/c1-6-12-10-20-11(2)9-18(12)13(8-16)7-14(19)17-15(3,4)5/h11-13H,6-10,16H2,1-5H3,(H,17,19)
InChIKeyQGCQNSGNWWIZSA-UHFFFAOYSA-N
XLogP1.12
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-2-(5-ethyl-2-methylmorpholin-4-yl)propan-1-ol
CID 104710882
2-(5-ethyl-2-methylmorpholin-4-yl)-4-methylsulfanylbutan-1-amine
CID 61424177
4-amino-3-(2,5-dimethylmorpholin-4-yl)-N-propan-2-ylbutanamide
CID 66429956
3-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-amine
CID 43575822
3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide
CID 79408801
2-(5-ethyl-2-methylmorpholin-4-yl)butanehydrazide
CID 63578551
N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butan-1-amine
CID 62462303
4-amino-3-(3-ethylmorpholin-4-yl)-N-methylbutanamide
CID 66427985
4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide
CID 66426517
4-amino-3-(2,5-dimethylmorpholin-4-yl)-1-piperidin-1-ylbutan-1-one
CID 66432542
4-(5-ethyl-2-methylmorpholin-4-yl)pentanoic acid
CID 62212916
4-amino-N-tert-butyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)butanamide
CID 102743220

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide?
The IUPAC name of 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide (CID 66432044) is 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide.
What is the SMILES notation for 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide?
The canonical SMILES for 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide is CCC1COC(C)CN1C(CN)CC(=O)NC(C)(C)C.
What is the InChIKey of 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide?
The InChIKey is QGCQNSGNWWIZSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-6-12-10-20-11(2)9-18(12)13(8-16)7-14(19)17-15(3,4)5/h11-13H,6-10,16H2,1-5H3,(H,17,19).
What are the key properties of 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide?
4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide has a molecular weight of 285.43 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide is sourced from PubChem (CID 66432044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).