N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide

C20H35N3O2 — CID 86908445

IUPACN-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(=O)N2CCCCC2)CC1)NCC1CCCCC1
InChIInChI=1S/C20H35N3O2/c24-19(21-15-17-7-3-1-4-8-17)16-22-13-9-18(10-14-22)20(25)23-11-5-2-6-12-23/h17-18H,1-16H2,(H,21,24)
InChIKeyBRJALQYZFFMTJH-UHFFFAOYSA-N
MW349.52 g/mol
LogP2.41
Rot. Bonds5

About N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide

N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide (PubChem CID 86908445) has the molecular formula C20H35N3O2 and a molecular weight of 349.52 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
PubChem CID86908445
Molecular FormulaC20H35N3O2
Molecular Weight349.52 g/mol
Exact Mass349.27
IUPAC NameN-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(=O)N2CCCCC2)CC1)NCC1CCCCC1
InChIInChI=1S/C20H35N3O2/c24-19(21-15-17-7-3-1-4-8-17)16-22-13-9-18(10-14-22)20(25)23-11-5-2-6-12-23/h17-18H,1-16H2,(H,21,24)
InChIKeyBRJALQYZFFMTJH-UHFFFAOYSA-N
XLogP2.41
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.52
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(cyclohexylmethylamino)-2-oxoethyl]piperidine-4-carboxylic acid
CID 119907812
N-(2-methoxyethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
CID 51072787
N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
CID 78788315
N-(3-cyclohexyloxypropyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 87015240
N-(cyclohexylmethyl)-2-(4-methylpiperazin-1-yl)acetamide
CID 1459544
N-cyclopropyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 134058309
N-benzyl-1-[2-(cyclohexylmethylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 86909124
N-(cyclobutylmethyl)-2-piperazin-1-ylacetamide
CID 43298878
N-(cyclobutylmethyl)-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 111334071
N-(cyclobutylmethyl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)acetamide
CID 47284297
N-cyclohexyl-2-[3-(piperidine-1-carbonyl)pyrrolidin-1-yl]acetamide
CID 166605706
2-(4-benzoylpiperazin-1-yl)-N-(cyclohexylmethyl)acetamide
CID 9223532

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide (CID 86908445) is N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide is O=C(CN1CCC(C(=O)N2CCCCC2)CC1)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
The InChIKey is BRJALQYZFFMTJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H35N3O2/c24-19(21-15-17-7-3-1-4-8-17)16-22-13-9-18(10-14-22)20(25)23-11-5-2-6-12-23/h17-18H,1-16H2,(H,21,24).
What are the key properties of N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide has a molecular weight of 349.52 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 86908445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).