3-methyl-1-piperidin-3-ylbutan-1-amine

C10H22N2 — CID 82412260

IUPAC3-methyl-1-piperidin-3-ylbutan-1-amine
SMILESCC(C)CC(N)C1CCCNC1
InChIInChI=1S/C10H22N2/c1-8(2)6-10(11)9-4-3-5-12-7-9/h8-10,12H,3-7,11H2,1-2H3
InChIKeyBXZZRCAFIOTRHE-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.36
Rot. Bonds3

About 3-methyl-1-piperidin-3-ylbutan-1-amine

3-methyl-1-piperidin-3-ylbutan-1-amine (PubChem CID 82412260) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 3-methyl-1-piperidin-3-ylbutan-1-amine.

Molecular Properties

Compound Name3-methyl-1-piperidin-3-ylbutan-1-amine
PubChem CID82412260
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name3-methyl-1-piperidin-3-ylbutan-1-amine
SMILESCC(C)CC(N)C1CCCNC1
InChIInChI=1S/C10H22N2/c1-8(2)6-10(11)9-4-3-5-12-7-9/h8-10,12H,3-7,11H2,1-2H3
InChIKeyBXZZRCAFIOTRHE-UHFFFAOYSA-N
XLogP1.36
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-Amino-2,2,6,6-tetramethylpiperidine
CID 37524
n-Butyl-2,2,6,6-tetramethyl-4-piperidinamine
CID 118285
5-Ethyl-2-methylpiperidine
CID 7727
1,3-Bis(4-piperidinyl)propane
CID 85631
2-Ethyl-3-(N-methylamino)hexylamine
CID 26635
N,N,2,2,6,6-Hexamethyl-4-piperidinamine
CID 547352
2,4,6-Trimethylpiperidine
CID 89562
N-(cyclohexylmethyl)-1-ethylpiperidin-4-amine
CID 2846481
3-Propylpiperidine
CID 114550
3-(1-Methylpyrrolidin-2-yl)piperidine
CID 219458
N,N-dimethyl-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine
CID 3018747
N-[1-(2-cyclohexylethyl)piperidin-4-yl]-N',N'-diethylpropane-1,3-diamine
CID 44389041

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-piperidin-3-ylbutan-1-amine?
The IUPAC name of 3-methyl-1-piperidin-3-ylbutan-1-amine (CID 82412260) is 3-methyl-1-piperidin-3-ylbutan-1-amine.
What is the SMILES notation for 3-methyl-1-piperidin-3-ylbutan-1-amine?
The canonical SMILES for 3-methyl-1-piperidin-3-ylbutan-1-amine is CC(C)CC(N)C1CCCNC1.
What is the InChIKey of 3-methyl-1-piperidin-3-ylbutan-1-amine?
The InChIKey is BXZZRCAFIOTRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-8(2)6-10(11)9-4-3-5-12-7-9/h8-10,12H,3-7,11H2,1-2H3.
What are the key properties of 3-methyl-1-piperidin-3-ylbutan-1-amine?
3-methyl-1-piperidin-3-ylbutan-1-amine has a molecular weight of 170.30 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-piperidin-3-ylbutan-1-amine is sourced from PubChem (CID 82412260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).