2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine

C13H28N2 — CID 80999733

IUPAC2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine
SMILESCNCC1CCC1N(CC(C)C)C(C)C
InChIInChI=1S/C13H28N2/c1-10(2)9-15(11(3)4)13-7-6-12(13)8-14-5/h10-14H,6-9H2,1-5H3
InChIKeyYBLBNDZDHFLRFU-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.35
Rot. Bonds6

About 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine

2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine (PubChem CID 80999733) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine.

Molecular Properties

Compound Name2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine
PubChem CID80999733
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine
SMILESCNCC1CCC1N(CC(C)C)C(C)C
InChIInChI=1S/C13H28N2/c1-10(2)9-15(11(3)4)13-7-6-12(13)8-14-5/h10-14H,6-9H2,1-5H3
InChIKeyYBLBNDZDHFLRFU-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylaminomethyl)-N,N-bis(3-methylbutyl)cyclobutan-1-amine
CID 114011270
N-butan-2-yl-N-ethyl-2-(methylaminomethyl)cyclobutan-1-amine
CID 80997727
2-[(cyclopropylamino)methyl]-N-(2-methylpropyl)-N-pentan-3-ylcyclobutan-1-amine
CID 81004629
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
2-[(cyclopropylamino)methyl]-N-ethyl-N-propan-2-ylcyclobutan-1-amine
CID 80998217
2-[(2-methylpropylamino)methyl]-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclobutan-1-amine
CID 80998753
2-(ethylaminomethyl)-N-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 80999159
N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 80999324
trans-(1S,2S)-2-[2-methylpropyl(propan-2-yl)amino]cyclopentan-1-ol
CID 102734588
3-[2-methylpropyl(propan-2-yl)amino]-4-propylcyclohexan-1-ol
CID 165497893
N-(2-methylpropyl)-N-[2-[(propan-2-ylamino)methyl]cyclobutyl]cyclopentanamine
CID 81004811

Frequently Asked Questions

What is the IUPAC name of 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine?
The IUPAC name of 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine (CID 80999733) is 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine.
What is the SMILES notation for 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine?
The canonical SMILES for 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine is CNCC1CCC1N(CC(C)C)C(C)C.
What is the InChIKey of 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine?
The InChIKey is YBLBNDZDHFLRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-10(2)9-15(11(3)4)13-7-6-12(13)8-14-5/h10-14H,6-9H2,1-5H3.
What are the key properties of 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine?
2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine is sourced from PubChem (CID 80999733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).