(1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone

C19H34N2O3 — CID 131925385

IUPAC(1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone
SMILESCCCOC1CCCN(C(=O)C2(N3CCOCC3)CCCCC2)C1
InChIInChI=1S/C19H34N2O3/c1-2-13-24-17-7-6-10-20(16-17)18(22)19(8-4-3-5-9-19)21-11-14-23-15-12-21/h17H,2-16H2,1H3
InChIKeyTUONHIUUDMSDPX-UHFFFAOYSA-N
MW338.49 g/mol
LogP2.44
Rot. Bonds5

About (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone

(1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone (PubChem CID 131925385) has the molecular formula C19H34N2O3 and a molecular weight of 338.49 g/mol. Its IUPAC name is (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name(1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone
PubChem CID131925385
Molecular FormulaC19H34N2O3
Molecular Weight338.49 g/mol
Exact Mass338.26
IUPAC Name(1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone
SMILESCCCOC1CCCN(C(=O)C2(N3CCOCC3)CCCCC2)C1
InChIInChI=1S/C19H34N2O3/c1-2-13-24-17-7-6-10-20(16-17)18(22)19(8-4-3-5-9-19)21-11-14-23-15-12-21/h17H,2-16H2,1H3
InChIKeyTUONHIUUDMSDPX-UHFFFAOYSA-N
XLogP2.44
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.49
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(aminomethyl)cyclopropyl]-(3-propoxypiperidin-1-yl)methanone
CID 80587134
(3-ethylpiperidin-3-yl)-(3-propoxypiperidin-1-yl)methanone
CID 63131367
(3-propan-2-ylpyrrolidin-3-yl)-(3-propoxypiperidin-1-yl)methanone
CID 106980335
(1-amino-3-methylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone
CID 64554425
N-ethyl-3-propoxypiperidine-1-carboxamide
CID 115595374
(4-methylpiperidin-1-yl)-(3-propoxypiperidin-1-yl)methanone
CID 116654904
2-amino-1-(3-propoxypiperidin-1-yl)butan-1-one
CID 61169570
(3S)-N-[4-(morpholin-4-ylmethyl)phenyl]-3-propoxypiperidine-1-carboxamide
CID 97443914
2-methoxy-1-(3-propoxypiperidin-1-yl)propan-1-one
CID 112687423
2-amino-4-methoxy-1-(3-propoxypiperidin-1-yl)butan-1-one
CID 62473426
3-methyl-1-(3-propoxypiperidine-1-carbonyl)pyrrolidine-3-carboxylic acid
CID 63147419
1-[[(3-propoxypiperidine-1-carbonyl)amino]methyl]cyclopropane-1-carboxylic acid
CID 115451446

Frequently Asked Questions

What is the IUPAC name of (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone?
The IUPAC name of (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone (CID 131925385) is (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone.
What is the SMILES notation for (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone?
The canonical SMILES for (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone is CCCOC1CCCN(C(=O)C2(N3CCOCC3)CCCCC2)C1.
What is the InChIKey of (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone?
The InChIKey is TUONHIUUDMSDPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2O3/c1-2-13-24-17-7-6-10-20(16-17)18(22)19(8-4-3-5-9-19)21-11-14-23-15-12-21/h17H,2-16H2,1H3.
What are the key properties of (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone?
(1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone has a molecular weight of 338.49 g/mol, XLogP of 2.44, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone is sourced from PubChem (CID 131925385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).