N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine

C13H26N2 — CID 80999784

IUPACN-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine
SMILESCCC(C)N(C)C1CCC1CNC1CC1
InChIInChI=1S/C13H26N2/c1-4-10(2)15(3)13-8-5-11(13)9-14-12-6-7-12/h10-14H,4-9H2,1-3H3
InChIKeyUDAOZDSRQCCVLD-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds6

About N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine

N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine (PubChem CID 80999784) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine
PubChem CID80999784
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine
SMILESCCC(C)N(C)C1CCC1CNC1CC1
InChIInChI=1S/C13H26N2/c1-4-10(2)15(3)13-8-5-11(13)9-14-12-6-7-12/h10-14H,4-9H2,1-3H3
InChIKeyUDAOZDSRQCCVLD-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(cyclopropylamino)methyl]-N-ethyl-N-propan-2-ylcyclobutan-1-amine
CID 80998217
2-[(cyclopropylamino)methyl]-N-(2-methylpropyl)-N-pentan-3-ylcyclobutan-1-amine
CID 81004629
N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N-methylcycloheptanamine
CID 80999025
2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine
CID 80998461
N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine
CID 80997684
N-methyl-2-(methylaminomethyl)-N-pentan-2-ylcyclobutan-1-amine
CID 80998399
N-methyl-2-(methylaminomethyl)-N-(1-methylsulfanylpropan-2-yl)cyclobutan-1-amine
CID 112665966
N'-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102997742
2-[(cyclopropylamino)methyl]-N-(3-methoxypropyl)-N-methylcyclobutan-1-amine
CID 80999921
N-methyl-N-pentan-2-yl-2-(propylaminomethyl)cyclobutan-1-amine
CID 80998398
1-[[[2-[(cyclopropylamino)methyl]cyclobutyl]-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105418059
N-butan-2-yl-N-ethyl-2-(methylaminomethyl)cyclobutan-1-amine
CID 80997727

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine?
The IUPAC name of N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine (CID 80999784) is N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine.
What is the SMILES notation for N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine?
The canonical SMILES for N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine is CCC(C)N(C)C1CCC1CNC1CC1.
What is the InChIKey of N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine?
The InChIKey is UDAOZDSRQCCVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-4-10(2)15(3)13-8-5-11(13)9-14-12-6-7-12/h10-14H,4-9H2,1-3H3.
What are the key properties of N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine?
N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine is sourced from PubChem (CID 80999784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).