N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide

C14H27N3O2 — CID 79393887

IUPACN-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide
SMILESCCN1CCOC(CNCCCC(=O)NC2CC2)C1
InChIInChI=1S/C14H27N3O2/c1-2-17-8-9-19-13(11-17)10-15-7-3-4-14(18)16-12-5-6-12/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyWWVDZUZLQWHDMM-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.36
Rot. Bonds8

About N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide

N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide (PubChem CID 79393887) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide
PubChem CID79393887
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide
SMILESCCN1CCOC(CNCCCC(=O)NC2CC2)C1
InChIInChI=1S/C14H27N3O2/c1-2-17-8-9-19-13(11-17)10-15-7-3-4-14(18)16-12-5-6-12/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyWWVDZUZLQWHDMM-UHFFFAOYSA-N
XLogP0.36
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(4-ethylmorpholin-2-yl)methylamino]-N-propylpropanamide
CID 79165758
3-bromo-N-[(4-ethylmorpholin-2-yl)methyl]propan-1-amine
CID 114293488
2-[(4-ethylmorpholin-2-yl)methylamino]-N-propylacetamide
CID 78960685
N-[(4-ethylmorpholin-2-yl)methyl]-6-iodohexan-1-amine
CID 107845055
N-[(4-ethylmorpholin-2-yl)methyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 79165338
tert-butyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]propyl]carbamate
CID 114399643
2-[(4-ethylmorpholin-2-yl)methylamino]ethyl carbamate
CID 83210717
2-(cyclopropylamino)-N-[(4-ethylmorpholin-2-yl)methyl]acetamide
CID 115976412
(Z)-2-ethyl-4-[(4-ethylmorpholin-2-yl)methylamino]but-2-enoic acid
CID 103267265
N-cyclopropyl-4-(2-morpholin-4-ylethylamino)butanamide
CID 79394794
3-[[(4-ethylmorpholin-2-yl)methylamino]methyl]cyclopentan-1-ol
CID 106128851
N-[(4-ethylmorpholin-2-yl)methyl]-3,3,3-trifluoropropan-1-amine
CID 79165763

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide?
The IUPAC name of N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide (CID 79393887) is N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide.
What is the SMILES notation for N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide?
The canonical SMILES for N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide is CCN1CCOC(CNCCCC(=O)NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide?
The InChIKey is WWVDZUZLQWHDMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-2-17-8-9-19-13(11-17)10-15-7-3-4-14(18)16-12-5-6-12/h12-13,15H,2-11H2,1H3,(H,16,18).
What are the key properties of N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide?
N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide has a molecular weight of 269.39 g/mol, XLogP of 0.36, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[(4-ethylmorpholin-2-yl)methylamino]butanamide is sourced from PubChem (CID 79393887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).