7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide

C19H31N3O2 — CID 119835990

IUPAC7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide
SMILESNCCCCCCC(=O)NC(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H31N3O2/c20-11-7-2-1-6-10-19(23)21-18(17-8-4-3-5-9-17)16-22-12-14-24-15-13-22/h3-5,8-9,18H,1-2,6-7,10-16,20H2,(H,21,23)
InChIKeyLDLZFLHYFGJNHI-UHFFFAOYSA-N
MW333.48 g/mol
LogP2.09
Rot. Bonds10

About 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide

7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide (PubChem CID 119835990) has the molecular formula C19H31N3O2 and a molecular weight of 333.48 g/mol. Its IUPAC name is 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide.

Molecular Properties

Compound Name7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide
PubChem CID119835990
Molecular FormulaC19H31N3O2
Molecular Weight333.48 g/mol
Exact Mass333.24
IUPAC Name7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide
SMILESNCCCCCCC(=O)NC(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H31N3O2/c20-11-7-2-1-6-10-19(23)21-18(17-8-4-3-5-9-17)16-22-12-14-24-15-13-22/h3-5,8-9,18H,1-2,6-7,10-16,20H2,(H,21,23)
InChIKeyLDLZFLHYFGJNHI-UHFFFAOYSA-N
XLogP2.09
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 52.09
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

7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide;dihydrochloride
CID 119835989
4-(methylamino)-N-(2-morpholin-4-yl-1-phenylethyl)butanamide;dihydrochloride
CID 119835993
N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-4-oxo-4-phenylbutanamide
CID 9149359
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
3-(2-aminophenyl)-N-(2-morpholin-4-yl-1-phenylethyl)propanamide;dihydrochloride
CID 120612134
7-amino-N-(2-hydroxy-1-phenylethyl)heptanamide
CID 63183869
4-(4-fluorophenyl)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]-4-oxobutanamide
CID 9148546
6-amino-N-(1,2-diphenylethyl)hexanamide
CID 42792343
N-(2-morpholin-4-yl-1-phenylethyl)-2-naphthalen-1-ylacetamide
CID 18166740
3-(2,4-dimethylphenyl)-N-(2-morpholin-4-yl-1-phenylethyl)propanamide
CID 24649384
2-fluoro-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 9149743
N-[(1R)-2-(4-methylpiperazin-1-yl)-1-phenylethyl]hexanamide
CID 95149857

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide?
The IUPAC name of 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide (CID 119835990) is 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide.
What is the SMILES notation for 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide?
The canonical SMILES for 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide is NCCCCCCC(=O)NC(CN1CCOCC1)c1ccccc1.
What is the InChIKey of 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide?
The InChIKey is LDLZFLHYFGJNHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O2/c20-11-7-2-1-6-10-19(23)21-18(17-8-4-3-5-9-17)16-22-12-14-24-15-13-22/h3-5,8-9,18H,1-2,6-7,10-16,20H2,(H,21,23).
What are the key properties of 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide?
7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide has a molecular weight of 333.48 g/mol, XLogP of 2.09, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(2-morpholin-4-yl-1-phenylethyl)heptanamide is sourced from PubChem (CID 119835990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).