1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride

C10H22Cl2N2 — CID 126796238

IUPAC1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride
SMILESCl.Cl.NC1(CN2CCCCC2)CCC1
InChIInChI=1S/C10H20N2.2ClH/c11-10(5-4-6-10)9-12-7-2-1-3-8-12;;/h1-9,11H2;2*1H
InChIKeyIRHBJSYZJLHGAE-UHFFFAOYSA-N
MW241.21 g/mol
LogP2.20
Rot. Bonds2

About 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride

1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride (PubChem CID 126796238) has the molecular formula C10H22Cl2N2 and a molecular weight of 241.21 g/mol. Its IUPAC name is 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride.

Molecular Properties

Compound Name1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride
PubChem CID126796238
Molecular FormulaC10H22Cl2N2
Molecular Weight241.21 g/mol
Exact Mass240.12
IUPAC Name1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride
SMILESCl.Cl.NC1(CN2CCCCC2)CCC1
InChIInChI=1S/C10H20N2.2ClH/c11-10(5-4-6-10)9-12-7-2-1-3-8-12;;/h1-9,11H2;2*1H
InChIKeyIRHBJSYZJLHGAE-UHFFFAOYSA-N
XLogP2.20
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.21
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,8-Diazaspiro(3.5)nonane dihydrochloride
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[1-(1-Piperidinylmethyl)cyclopropyl]amine dihydrochloride
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1-[(Piperidin-1-yl)methyl]cyclobutan-1-amine
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5-Methyl-5,8-diazaspiro[3.5]nonane
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3-(Piperidin-1-yl)bicyclo(1.1.1)pentan-1-amine dihydrochloride
CID 163342165
1-(Cyclobutylmethyl)piperazine dihydrochloride
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1-[[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]methyl]cyclobutan-1-amine
CID 81170593
1-Cyclobutyl-3-(fluoromethyl)piperidin-3-amine
CID 115017146
2-Methyl-1-(piperidin-1-yl)propan-2-amine
CID 2794702
N-chloro-2-methyl-1-(1-methylpiperidin-1-ium-1-yl)propan-2-amine chloride
CID 44465324
N-chloro-2-methyl-1-(1-methylpiperidin-1-ium-1-yl)propan-2-amine
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8-Methyl-5,8-diazaspiro[3.5]nonane
CID 58803028

Frequently Asked Questions

What is the IUPAC name of 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride?
The IUPAC name of 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride (CID 126796238) is 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride.
What is the SMILES notation for 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride?
The canonical SMILES for 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride is Cl.Cl.NC1(CN2CCCCC2)CCC1.
What is the InChIKey of 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride?
The InChIKey is IRHBJSYZJLHGAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2.2ClH/c11-10(5-4-6-10)9-12-7-2-1-3-8-12;;/h1-9,11H2;2*1H.
What are the key properties of 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride?
1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride has a molecular weight of 241.21 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperidin-1-ylmethyl)cyclobutan-1-amine;dihydrochloride is sourced from PubChem (CID 126796238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).