4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide

C16H25N3O2 — CID 119860982

IUPAC4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide
SMILESNCCCC(=O)Nc1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O2/c17-8-1-2-16(20)18-15-5-3-14(4-6-15)7-9-19-10-12-21-13-11-19/h3-6H,1-2,7-13,17H2,(H,18,20)
InChIKeyMQJNHZQKEWJREM-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.24
Rot. Bonds7

About 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide

4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide (PubChem CID 119860982) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide.

Molecular Properties

Compound Name4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide
PubChem CID119860982
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC Name4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide
SMILESNCCCC(=O)Nc1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O2/c17-8-1-2-16(20)18-15-5-3-14(4-6-15)7-9-19-10-12-21-13-11-19/h3-6H,1-2,7-13,17H2,(H,18,20)
InChIKeyMQJNHZQKEWJREM-UHFFFAOYSA-N
XLogP1.24
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 119862086
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CID 16779088
3-(4-chlorophenyl)sulfanyl-N-[4-(2-morpholin-4-ylethyl)phenyl]propanamide
CID 55905661
N-(4-aminophenyl)-4-morpholin-4-ylbutanamide
CID 16779642
N-[4-(2-morpholin-4-ylethyl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 55905013
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CID 119860951
3-amino-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide;dihydrochloride
CID 119840811
3-[(4-fluorophenyl)sulfonylamino]-N-[4-(2-morpholin-4-ylethyl)phenyl]propanamide
CID 55976370
3-(4-methylphenyl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide
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2-amino-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 60672694
4-(aminomethyl)-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]oxane-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide?
The IUPAC name of 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide (CID 119860982) is 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide.
What is the SMILES notation for 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide?
The canonical SMILES for 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide is NCCCC(=O)Nc1ccc(CCN2CCOCC2)cc1.
What is the InChIKey of 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide?
The InChIKey is MQJNHZQKEWJREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c17-8-1-2-16(20)18-15-5-3-14(4-6-15)7-9-19-10-12-21-13-11-19/h3-6H,1-2,7-13,17H2,(H,18,20).
What are the key properties of 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide?
4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide has a molecular weight of 291.40 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide is sourced from PubChem (CID 119860982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).