3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide

C19H27N3O3 — CID 75509204

IUPAC3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide
SMILESCCCn1ccc2ccc(NC(=O)N3CCOCC3CC(C)O)cc21
InChIInChI=1S/C19H27N3O3/c1-3-7-21-8-6-15-4-5-16(12-18(15)21)20-19(24)22-9-10-25-13-17(22)11-14(2)23/h4-6,8,12,14,17,23H,3,7,9-11,13H2,1-2H3,(H,20,24)
InChIKeyVOYYFSAHKCWYPT-UHFFFAOYSA-N
MW345.44 g/mol
LogP3.05
Rot. Bonds5

About 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide

3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide (PubChem CID 75509204) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide.

Molecular Properties

Compound Name3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide
PubChem CID75509204
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC Name3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide
SMILESCCCn1ccc2ccc(NC(=O)N3CCOCC3CC(C)O)cc21
InChIInChI=1S/C19H27N3O3/c1-3-7-21-8-6-15-4-5-16(12-18(15)21)20-19(24)22-9-10-25-13-17(22)11-14(2)23/h4-6,8,12,14,17,23H,3,7,9-11,13H2,1-2H3,(H,20,24)
InChIKeyVOYYFSAHKCWYPT-UHFFFAOYSA-N
XLogP3.05
TPSA66.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-3-(2-methylpropyl)-N-phenylmorpholine-4-carboxamide
CID 95904890
N-[4-(2-methylpropanoylamino)phenyl]-3-(2-methylpropyl)morpholine-4-carboxamide
CID 56794682
3-(hydroxymethyl)-N-(1-propylindol-6-yl)piperidine-1-carboxamide
CID 111474969
(3S)-3-methylsulfonyl-N-(1-propylindol-6-yl)pyrrolidine-1-carboxamide
CID 125141718
4-(1-hydroxyethyl)-N-(1-propylindol-5-yl)piperidine-1-carboxamide
CID 111424917
2-(furan-2-yl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide
CID 126786711
2-methyl-3-(methylamino)-N-(1-propylindol-6-yl)propanamide;hydrochloride
CID 119797080
2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide
CID 119331183
(3S)-N-(4-acetamido-3-methoxyphenyl)-3-[(2R)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide
CID 97058385
2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride
CID 119331199
5-[(3-ethylmorpholine-4-carbonyl)amino]-2-fluorobenzoic acid
CID 61202010
(3S)-3-(2-methylpropyl)-N-(6-morpholin-4-yl-3-pyridinyl)morpholine-4-carboxamide
CID 95904886

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide?
The IUPAC name of 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide (CID 75509204) is 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide.
What is the SMILES notation for 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide?
The canonical SMILES for 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide is CCCn1ccc2ccc(NC(=O)N3CCOCC3CC(C)O)cc21.
What is the InChIKey of 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide?
The InChIKey is VOYYFSAHKCWYPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-3-7-21-8-6-15-4-5-16(12-18(15)21)20-19(24)22-9-10-25-13-17(22)11-14(2)23/h4-6,8,12,14,17,23H,3,7,9-11,13H2,1-2H3,(H,20,24).
What are the key properties of 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide?
3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide has a molecular weight of 345.44 g/mol, XLogP of 3.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxypropyl)-N-(1-propylindol-6-yl)morpholine-4-carboxamide is sourced from PubChem (CID 75509204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).