1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine

C9H16N4O — CID 43556526

IUPAC1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine
SMILESCc1nnc(CN2CCC(N)CC2)o1
InChIInChI=1S/C9H16N4O/c1-7-11-12-9(14-7)6-13-4-2-8(10)3-5-13/h8H,2-6,10H2,1H3
InChIKeyDNZNWQRVEPSYSF-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.30
Rot. Bonds2

About 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine

1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine (PubChem CID 43556526) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine
PubChem CID43556526
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine
SMILESCc1nnc(CN2CCC(N)CC2)o1
InChIInChI=1S/C9H16N4O/c1-7-11-12-9(14-7)6-13-4-2-8(10)3-5-13/h8H,2-6,10H2,1H3
InChIKeyDNZNWQRVEPSYSF-UHFFFAOYSA-N
XLogP0.30
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]cyclopropanecarboxamide
CID 38146777
N-[1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]propanamide
CID 45826491
N-[1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]propane-1-sulfonamide
CID 75461089
Dimethyl({[5-(piperidin-2-yl)-1,3,4-oxadiazol-2-yl]methyl})amine
CID 82673192
N-cyclopentyl-N,N'-dimethyl-N'-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethane-1,2-diamine
CID 91839958
2-[[(3S)-4-cyclopentyl-3-methylpiperazin-1-yl]methyl]-5-methyl-1,3,4-oxadiazole
CID 164637327
4-({3-Methyl-1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-4,5-dihydro-1h-pyrazol-5-yl}methyl)morpholine
CID 176515696
N,N-dimethyl-1-[[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-3-amine
CID 146121185
2,2-dimethyl-N-(1-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperidin-4-yl)propanamide
CID 163354475
2,2-dimethyl-N-(1-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperidin-3-yl)propanamide
CID 163357594
N-(1-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperidin-3-yl)acetamide
CID 172880714
N-[[1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]methyl]acetamide
CID 51081654

Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine?
The IUPAC name of 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine (CID 43556526) is 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine is Cc1nnc(CN2CCC(N)CC2)o1.
What is the InChIKey of 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine?
The InChIKey is DNZNWQRVEPSYSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-7-11-12-9(14-7)6-13-4-2-8(10)3-5-13/h8H,2-6,10H2,1H3.
What are the key properties of 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine?
1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine has a molecular weight of 196.25 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 43556526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).