N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide

C20H38N4O4 — CID 3091

💊View drug profile → dimorpholamine
IUPACN-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide
SMILESCCCCN(CCN(CCCC)C(=O)N1CCOCC1)C(=O)N1CCOCC1
InChIInChI=1S/C20H38N4O4/c1-3-5-7-21(19(25)23-11-15-27-16-12-23)9-10-22(8-6-4-2)20(26)24-13-17-28-18-14-24/h3-18H2,1-2H3
InChIKeyHZTMGWSBSDLALI-UHFFFAOYSA-N
MW398.55 g/mol
LogP2.10
Rot. Bonds9

About N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide

N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide (PubChem CID 3091) has the molecular formula C20H38N4O4 and a molecular weight of 398.55 g/mol. Its IUPAC name is N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide
PubChem CID3091
Molecular FormulaC20H38N4O4
Molecular Weight398.55 g/mol
Exact Mass398.29
IUPAC NameN-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide
SMILESCCCCN(CCN(CCCC)C(=O)N1CCOCC1)C(=O)N1CCOCC1
InChIInChI=1S/C20H38N4O4/c1-3-5-7-21(19(25)23-11-15-27-16-12-23)9-10-22(8-6-4-2)20(26)24-13-17-28-18-14-24/h3-18H2,1-2H3
InChIKeyHZTMGWSBSDLALI-UHFFFAOYSA-N
XLogP2.10
TPSA65.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.55
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide
CID 111119288
2-[1,4-oxazepane-4-carbonyl(propyl)amino]acetic acid
CID 62967639
N-butyl-N-(2-hydroxyethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 61444420
N-(2-hydroxyethyl)-N-(2-methoxyethyl)morpholine-4-carboxamide
CID 115608967
N-ethyl-N-(2-ethylbutyl)morpholine-4-carboxamide
CID 115589059
N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide
CID 107206795
N-butyl-N-[[4-[[(2,2,2-trifluoroacetyl)amino]carbamoyl]phenyl]methyl]morpholine-4-carboxamide
CID 140894941
2-[2-aminoethyl(butyl)amino]-1-morpholin-4-ylethanone
CID 63758934
2-[4-[butyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid
CID 66435406
N,N-dibutyl-4-[2-(3-methyl-2-oxoimidazolidin-1-yl)ethyl]piperazine-1-carboxamide
CID 154271776
ethane;1-morpholin-4-ylhexan-1-one
CID 143214280
N-(2-aminoethyl)-N-butyl-3-methylpiperidine-1-carboxamide
CID 79162694

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide?
The IUPAC name of N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide (CID 3091) is N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide.
What is the SMILES notation for N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide?
The canonical SMILES for N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide is CCCCN(CCN(CCCC)C(=O)N1CCOCC1)C(=O)N1CCOCC1.
What is the InChIKey of N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide?
The InChIKey is HZTMGWSBSDLALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N4O4/c1-3-5-7-21(19(25)23-11-15-27-16-12-23)9-10-22(8-6-4-2)20(26)24-13-17-28-18-14-24/h3-18H2,1-2H3.
What are the key properties of N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide?
N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide has a molecular weight of 398.55 g/mol, XLogP of 2.10, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 3091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).