1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride

C17H31ClN4O3 — CID 119750464

IUPAC1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride
SMILESCl.O=C(NC1CCCCC1)NC1CCN(C(=O)C2COCCN2)CC1
InChIInChI=1S/C17H30N4O3.ClH/c22-16(15-12-24-11-8-18-15)21-9-6-14(7-10-21)20-17(23)19-13-4-2-1-3-5-13;/h13-15,18H,1-12H2,(H2,19,20,23);1H
InChIKeyZZTKVZGBFKPYDL-UHFFFAOYSA-N
MW374.91 g/mol
LogP1.02
Rot. Bonds3

About 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride

1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride (PubChem CID 119750464) has the molecular formula C17H31ClN4O3 and a molecular weight of 374.91 g/mol. Its IUPAC name is 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride
PubChem CID119750464
Molecular FormulaC17H31ClN4O3
Molecular Weight374.91 g/mol
Exact Mass374.21
IUPAC Name1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride
SMILESCl.O=C(NC1CCCCC1)NC1CCN(C(=O)C2COCCN2)CC1
InChIInChI=1S/C17H30N4O3.ClH/c22-16(15-12-24-11-8-18-15)21-9-6-14(7-10-21)20-17(23)19-13-4-2-1-3-5-13;/h13-15,18H,1-12H2,(H2,19,20,23);1H
InChIKeyZZTKVZGBFKPYDL-UHFFFAOYSA-N
XLogP1.02
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.91
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 119755465
N-cycloheptylmorpholine-3-carboxamide;hydrochloride
CID 119674644
[1-(morpholine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone;hydrochloride
CID 119700492
N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]morpholine-3-carboxamide
CID 119808763
[(3R)-morpholin-3-yl]-piperazin-1-ylmethanone;hydrochloride
CID 130992240
[(3S)-3-hydroxypyrrolidin-1-yl]-[(3R)-morpholin-3-yl]methanone;hydrochloride
CID 130608601
5-methyl-N-[1-(morpholine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride
CID 119759722
morpholin-3-yl-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103812428
1-cyclohexyl-3-[1-(piperidine-4-carbonyl)piperidin-4-yl]urea
CID 119304273
N-cyclohexyl-4-[(2-morpholin-3-ylcyclopentyl)amino]piperidine-1-carboxamide;hydrochloride
CID 120916310
1-[1-(cyclopentanecarbonyl)piperidin-4-yl]-3-cyclopentylurea
CID 110820027
morpholin-3-yl-(4-phenylmethoxypiperidin-1-yl)methanone;hydrochloride
CID 119697027

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride?
The IUPAC name of 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride (CID 119750464) is 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride?
The canonical SMILES for 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride is Cl.O=C(NC1CCCCC1)NC1CCN(C(=O)C2COCCN2)CC1.
What is the InChIKey of 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride?
The InChIKey is ZZTKVZGBFKPYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O3.ClH/c22-16(15-12-24-11-8-18-15)21-9-6-14(7-10-21)20-17(23)19-13-4-2-1-3-5-13;/h13-15,18H,1-12H2,(H2,19,20,23);1H.
What are the key properties of 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride?
1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride has a molecular weight of 374.91 g/mol, XLogP of 1.02, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride is sourced from PubChem (CID 119750464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).