di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine

C17H34N4O — CID 174339916

IUPACdi(piperidin-1-yl)methanone;1-methylpiperidin-4-amine
SMILESCN1CCC(N)CC1.O=C(N1CCCCC1)N1CCCCC1
InChIInChI=1S/C11H20N2O.C6H14N2/c14-11(12-7-3-1-4-8-12)13-9-5-2-6-10-13;1-8-4-2-6(7)3-5-8/h1-10H2;6H,2-5,7H2,1H3
InChIKeyFHZRWMUTOFACRQ-UHFFFAOYSA-N
MW310.49 g/mol
LogP2.12
Rot. Bonds

About di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine

di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine (PubChem CID 174339916) has the molecular formula C17H34N4O and a molecular weight of 310.49 g/mol. Its IUPAC name is di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine.

Molecular Properties

Compound Namedi(piperidin-1-yl)methanone;1-methylpiperidin-4-amine
PubChem CID174339916
Molecular FormulaC17H34N4O
Molecular Weight310.49 g/mol
Exact Mass310.27
IUPAC Namedi(piperidin-1-yl)methanone;1-methylpiperidin-4-amine
SMILESCN1CCC(N)CC1.O=C(N1CCCCC1)N1CCCCC1
InChIInChI=1S/C11H20N2O.C6H14N2/c14-11(12-7-3-1-4-8-12)13-9-5-2-6-10-13;1-8-4-2-6(7)3-5-8/h1-10H2;6H,2-5,7H2,1H3
InChIKeyFHZRWMUTOFACRQ-UHFFFAOYSA-N
XLogP2.12
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.49
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

azocan-1-yl-(4-methylpiperazin-1-yl)methanone;hydrochloride
CID 117068106
(3-aminopiperidin-1-yl)-(4-methylpiperazin-1-yl)methanone
CID 131532864
(3S)-1-(4-aminopiperidine-1-carbonyl)piperidine-3-carboxylic acid
CID 81125729
(4R)-1-methylazocan-4-amine
CID 166102588
(4-aminopiperidin-1-yl)-[1-(pyrrolidine-1-carbonyl)piperidin-3-yl]methanone;hydrochloride
CID 119376301
[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-(azepan-1-yl)methanone
CID 80552459
ethane;1-methylpiperidin-4-amine
CID 123622295
(3-aminopiperidin-1-yl)-pyrrolidin-1-ylmethanone
CID 79161440
cyclobutanamine;1-methylpyrrolidine
CID 167503696
1-(4-methyl-1,4-diazepane-1-carbonyl)pyrrolidine-3-carboxylic acid
CID 63030858
(4-aminopiperidin-1-yl)-[(3R)-1-methylpiperidin-3-yl]methanone
CID 129493268
cycloheptyl-(1-methylpiperidin-4-yl)methanone
CID 144802313

Frequently Asked Questions

What is the IUPAC name of di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine?
The IUPAC name of di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine (CID 174339916) is di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine.
What is the SMILES notation for di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine?
The canonical SMILES for di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine is CN1CCC(N)CC1.O=C(N1CCCCC1)N1CCCCC1.
What is the InChIKey of di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine?
The InChIKey is FHZRWMUTOFACRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.C6H14N2/c14-11(12-7-3-1-4-8-12)13-9-5-2-6-10-13;1-8-4-2-6(7)3-5-8/h1-10H2;6H,2-5,7H2,1H3.
What are the key properties of di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine?
di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine has a molecular weight of 310.49 g/mol, XLogP of 2.12, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine is sourced from PubChem (CID 174339916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).