[4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone

C23H35N3O2 — CID 118755342

IUPAC[4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1ccc(N2CCC(NC3CCCCC3)CC2)cc1)N1CCCC(O)C1
InChIInChI=1S/C23H35N3O2/c27-22-7-4-14-26(17-22)23(28)18-8-10-21(11-9-18)25-15-12-20(13-16-25)24-19-5-2-1-3-6-19/h8-11,19-20,22,24,27H,1-7,12-17H2
InChIKeyUYJJAFBIDFLALE-UHFFFAOYSA-N
MW385.55 g/mol
LogP3.17
Rot. Bonds4

About [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone

[4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone (PubChem CID 118755342) has the molecular formula C23H35N3O2 and a molecular weight of 385.55 g/mol. Its IUPAC name is [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name[4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone
PubChem CID118755342
Molecular FormulaC23H35N3O2
Molecular Weight385.55 g/mol
Exact Mass385.27
IUPAC Name[4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1ccc(N2CCC(NC3CCCCC3)CC2)cc1)N1CCCC(O)C1
InChIInChI=1S/C23H35N3O2/c27-22-7-4-14-26(17-22)23(28)18-8-10-21(11-9-18)25-15-12-20(13-16-25)24-19-5-2-1-3-6-19/h8-11,19-20,22,24,27H,1-7,12-17H2
InChIKeyUYJJAFBIDFLALE-UHFFFAOYSA-N
XLogP3.17
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.55
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-hydroxypiperidin-1-yl)-[4-[4-[(1-morpholin-4-ylcyclohexyl)methylamino]piperidin-1-yl]phenyl]methanone
CID 45187786
(3-hydroxypiperidin-1-yl)-(4-iodophenyl)methanone
CID 43390619
4-[(3S)-3-hydroxypiperidine-1-carbonyl]benzamide
CID 93040598
[4-[4-[(2,6-difluoro-3-methylphenyl)methylamino]piperidin-1-yl]phenyl]-[(3R)-3-hydroxypiperidin-1-yl]methanone
CID 125155531
[4-[4-[(2,3-dimethoxyphenyl)methylamino]piperidin-1-yl]phenyl]-[(3R)-3-hydroxypiperidin-1-yl]methanone
CID 42436719
[(3S)-3-hydroxypiperidin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 93032469
[3-(methylamino)piperidin-1-yl]-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone
CID 119493758
[4-(ethylamino)phenyl]-(3-hydroxypiperidin-1-yl)methanone
CID 62178263
[(3R)-3-hydroxypiperidin-1-yl]-[4-[4-[methyl-[2-(4-methylphenoxy)ethyl]amino]piperidin-1-yl]phenyl]methanone
CID 26342515
(3,4-dihydroxyphenyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107300644
(4-piperidin-1-ylphenyl)-pyrrolidin-1-ylmethanone
CID 21366931
N-[1-[4-(dimethylamino)phenyl]piperidin-4-yl]-3-hydroxypiperidine-1-carboxamide
CID 111508241

Frequently Asked Questions

What is the IUPAC name of [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone?
The IUPAC name of [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone (CID 118755342) is [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone is O=C(c1ccc(N2CCC(NC3CCCCC3)CC2)cc1)N1CCCC(O)C1.
What is the InChIKey of [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone?
The InChIKey is UYJJAFBIDFLALE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O2/c27-22-7-4-14-26(17-22)23(28)18-8-10-21(11-9-18)25-15-12-20(13-16-25)24-19-5-2-1-3-6-19/h8-11,19-20,22,24,27H,1-7,12-17H2.
What are the key properties of [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone?
[4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone has a molecular weight of 385.55 g/mol, XLogP of 3.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-(cyclohexylamino)piperidin-1-yl]phenyl]-(3-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 118755342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).