formaldehyde;4-methyl-1-(3-methylbutyl)piperidine

C12H25NO — CID 143870022

IUPACformaldehyde;4-methyl-1-(3-methylbutyl)piperidine
SMILESC=O.CC(C)CCN1CCC(C)CC1
InChIInChI=1S/C11H23N.CH2O/c1-10(2)4-7-12-8-5-11(3)6-9-12;1-2/h10-11H,4-9H2,1-3H3;1H2
InChIKeyYUPYSWZHHZIRQC-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.58
Rot. Bonds3

About formaldehyde;4-methyl-1-(3-methylbutyl)piperidine

formaldehyde;4-methyl-1-(3-methylbutyl)piperidine (PubChem CID 143870022) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is formaldehyde;4-methyl-1-(3-methylbutyl)piperidine.

Molecular Properties

Compound Nameformaldehyde;4-methyl-1-(3-methylbutyl)piperidine
PubChem CID143870022
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Nameformaldehyde;4-methyl-1-(3-methylbutyl)piperidine
SMILESC=O.CC(C)CCN1CCC(C)CC1
InChIInChI=1S/C11H23N.CH2O/c1-10(2)4-7-12-8-5-11(3)6-9-12;1-2/h10-11H,4-9H2,1-3H3;1H2
InChIKeyYUPYSWZHHZIRQC-UHFFFAOYSA-N
XLogP2.58
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-methyl-4-(3-methylbutyl)piperidine;4-methyl-1-(3-methylbutyl)piperidine
CID 176985881
3-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]butan-1-amine
CID 61240080
3-iodo-1-(3-methylbutyl)pyrrolidine
CID 126716401
3-fluoro-1-(3-methylbutyl)pyrrolidine
CID 67990286
4-methyl-1-[[4-(3-methylbutyl)piperazin-1-yl]methyl]cyclohexan-1-ol
CID 111462447
1-(3-methylbutyl)-4-propan-2-ylsulfanylpiperidine
CID 167480358
1-(3-methylbutyl)-N-propan-2-ylpiperidin-4-amine
CID 164928841
ethane;4-methoxy-1-(3-methylbutyl)piperidine
CID 155574416
N'-hydroxy-1-(3-methylbutyl)piperidine-4-carboximidamide
CID 77038741
imino-methyl-[1-(3-methylbutyl)piperidin-4-yl]-oxo-λ6-sulfane
CID 167284354
3-bromo-1-(3-methylbutyl)pyrrolidine
CID 80676511
N,N-dimethyl-1-(3-methylbutyl)piperidine-4-carboxamide
CID 175620267

Frequently Asked Questions

What is the IUPAC name of formaldehyde;4-methyl-1-(3-methylbutyl)piperidine?
The IUPAC name of formaldehyde;4-methyl-1-(3-methylbutyl)piperidine (CID 143870022) is formaldehyde;4-methyl-1-(3-methylbutyl)piperidine.
What is the SMILES notation for formaldehyde;4-methyl-1-(3-methylbutyl)piperidine?
The canonical SMILES for formaldehyde;4-methyl-1-(3-methylbutyl)piperidine is C=O.CC(C)CCN1CCC(C)CC1.
What is the InChIKey of formaldehyde;4-methyl-1-(3-methylbutyl)piperidine?
The InChIKey is YUPYSWZHHZIRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N.CH2O/c1-10(2)4-7-12-8-5-11(3)6-9-12;1-2/h10-11H,4-9H2,1-3H3;1H2.
What are the key properties of formaldehyde;4-methyl-1-(3-methylbutyl)piperidine?
formaldehyde;4-methyl-1-(3-methylbutyl)piperidine has a molecular weight of 199.34 g/mol, XLogP of 2.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;4-methyl-1-(3-methylbutyl)piperidine is sourced from PubChem (CID 143870022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).