N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide

C12H22N2O3 — CID 155599544

IUPACN-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide
SMILESCOCCCCC(=O)N1CCC(NC=O)CC1
InChIInChI=1S/C12H22N2O3/c1-17-9-3-2-4-12(16)14-7-5-11(6-8-14)13-10-15/h10-11H,2-9H2,1H3,(H,13,15)
InChIKeyZUOSTHXSPQMSRB-UHFFFAOYSA-N
MW242.32 g/mol
LogP0.54
Rot. Bonds7

About N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide

N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide (PubChem CID 155599544) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide.

Molecular Properties

Compound NameN-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide
PubChem CID155599544
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC NameN-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide
SMILESCOCCCCC(=O)N1CCC(NC=O)CC1
InChIInChI=1S/C12H22N2O3/c1-17-9-3-2-4-12(16)14-7-5-11(6-8-14)13-10-15/h10-11H,2-9H2,1H3,(H,13,15)
InChIKeyZUOSTHXSPQMSRB-UHFFFAOYSA-N
XLogP0.54
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-propanoylpiperidin-4-yl)formamide
CID 87856562
1-[4-(cyclopropylmethylamino)piperidin-1-yl]-4-methoxybutan-1-one;hydrochloride
CID 119622312
N-[1-(3-methylbutanoyl)piperidin-4-yl]formamide
CID 130209713
1-[4-(2-methoxyethyl)piperidin-1-yl]pentan-1-one
CID 90437878
2-[1-(3-methoxypropanoyl)piperidin-4-yl]acetic acid
CID 79615303
1-(3-hydroxypiperidin-1-yl)-5-methoxypentan-1-one
CID 110909883
methyl 2-(1-hexanoylpiperidin-4-yl)acetate
CID 94830715
1-[4-(methylamino)piperidin-1-yl]hexan-1-one
CID 60818219
tert-butyl N-[(3S)-1-(4-methoxybutanoyl)pyrrolidin-3-yl]carbamate
CID 171063625
1-[4-(2-methylpropyl)piperidin-1-yl]-5-propan-2-yloxypentan-1-one
CID 165108720
1-[4-(2-aminoethoxy)piperidin-1-yl]-4-methoxybutan-1-one
CID 82701031
1-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-4-methoxybutan-1-one
CID 115775093

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide?
The IUPAC name of N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide (CID 155599544) is N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide.
What is the SMILES notation for N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide?
The canonical SMILES for N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide is COCCCCC(=O)N1CCC(NC=O)CC1.
What is the InChIKey of N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide?
The InChIKey is ZUOSTHXSPQMSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-17-9-3-2-4-12(16)14-7-5-11(6-8-14)13-10-15/h10-11H,2-9H2,1H3,(H,13,15).
What are the key properties of N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide?
N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide has a molecular weight of 242.32 g/mol, XLogP of 0.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methoxypentanoyl)piperidin-4-yl]formamide is sourced from PubChem (CID 155599544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).