N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide

C19H28ClN3O2 — CID 143229783

IUPACN-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide
SMILESO=CN(CCC1CCCN(c2ncccc2Cl)C1)C1CCC(O)CC1
InChIInChI=1S/C19H28ClN3O2/c20-18-4-1-10-21-19(18)22-11-2-3-15(13-22)9-12-23(14-24)16-5-7-17(25)8-6-16/h1,4,10,14-17,25H,2-3,5-9,11-13H2
InChIKeyWZXZFBLWEGLAHA-UHFFFAOYSA-N
MW365.91 g/mol
LogP3.10
Rot. Bonds6

About N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide

N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide (PubChem CID 143229783) has the molecular formula C19H28ClN3O2 and a molecular weight of 365.91 g/mol. Its IUPAC name is N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide.

Molecular Properties

Compound NameN-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide
PubChem CID143229783
Molecular FormulaC19H28ClN3O2
Molecular Weight365.91 g/mol
Exact Mass365.19
IUPAC NameN-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide
SMILESO=CN(CCC1CCCN(c2ncccc2Cl)C1)C1CCC(O)CC1
InChIInChI=1S/C19H28ClN3O2/c20-18-4-1-10-21-19(18)22-11-2-3-15(13-22)9-12-23(14-24)16-5-7-17(25)8-6-16/h1,4,10,14-17,25H,2-3,5-9,11-13H2
InChIKeyWZXZFBLWEGLAHA-UHFFFAOYSA-N
XLogP3.10
TPSA56.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.91
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-N-[2-[1-(3-methyl-2-pyridinyl)piperidin-3-yl]ethyl]formamide;ethane
CID 143229407
N-(2-chlorophenyl)-N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]formamide
CID 143229668
N-[2-[1-(3-cyano-2-pyridinyl)piperidin-3-yl]ethyl]-N-(oxan-4-yl)formamide
CID 143229666
N-cyclohexyl-N-[3-[1-(3-fluoro-2-pyridinyl)piperidin-3-yl]propyl]formamide
CID 143229815
N-cyclohexyl-N-[2-[1-[3-fluoro-4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]ethyl]formamide
CID 143229533
N-cyclohexyl-N-[2-(1-phenylpiperidin-3-yl)ethyl]formamide
CID 143229397
N-[3-[1-(2-fluoro-4-pyridin-3-yloxyphenyl)piperidin-3-yl]propyl]-N-(4-hydroxycyclohexyl)formamide
CID 143229435
3-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 45186154
N-cyclohexyl-N-[2-(1-quinolin-2-ylpiperidin-3-yl)ethyl]formamide;ethane
CID 143229721
N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide
CID 143229638
2-(3-bromopiperidin-1-yl)-3-chloropyridine
CID 80672727
N-[3-[1-(3-bromo-5-methyl-2-pyridinyl)piperidin-3-yl]propyl]-N-cyclohexylformamide
CID 143229447

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide?
The IUPAC name of N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide (CID 143229783) is N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide.
What is the SMILES notation for N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide?
The canonical SMILES for N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide is O=CN(CCC1CCCN(c2ncccc2Cl)C1)C1CCC(O)CC1.
What is the InChIKey of N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide?
The InChIKey is WZXZFBLWEGLAHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28ClN3O2/c20-18-4-1-10-21-19(18)22-11-2-3-15(13-22)9-12-23(14-24)16-5-7-17(25)8-6-16/h1,4,10,14-17,25H,2-3,5-9,11-13H2.
What are the key properties of N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide?
N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide has a molecular weight of 365.91 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(3-chloro-2-pyridinyl)piperidin-3-yl]ethyl]-N-(4-hydroxycyclohexyl)formamide is sourced from PubChem (CID 143229783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).