N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine

C13H28N2 — CID 80999324

IUPACN-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
SMILESCC(C)CN(C)C1CCC1CNC(C)C
InChIInChI=1S/C13H28N2/c1-10(2)9-15(5)13-7-6-12(13)8-14-11(3)4/h10-14H,6-9H2,1-5H3
InChIKeyNSLNMBCLQMBSKU-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.35
Rot. Bonds6

About N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine

N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine (PubChem CID 80999324) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine.

Molecular Properties

Compound NameN-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
PubChem CID80999324
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
SMILESCC(C)CN(C)C1CCC1CNC(C)C
InChIInChI=1S/C13H28N2/c1-10(2)9-15(5)13-7-6-12(13)8-14-11(3)4/h10-14H,6-9H2,1-5H3
InChIKeyNSLNMBCLQMBSKU-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-(ethylaminomethyl)-N-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 80999159
N-(2-methylpropyl)-N-[2-[(propan-2-ylamino)methyl]cyclobutyl]cyclopentanamine
CID 81004811
N-methyl-N-[2-[(propan-2-ylamino)methyl]cyclobutyl]cyclopentanamine
CID 80999304
N,N-dibutyl-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 80997887
N-[(2-methoxyphenyl)methyl]-N-methyl-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 80999243
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 81004725
N-[1-(4-chlorophenyl)ethyl]-N-methyl-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 80999920
N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 81005573
N-[1-(3-chlorophenyl)ethyl]-N-methyl-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine
CID 80998947
2-(methylaminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine
CID 80999733
N-[[2-(3-methylbutyl)cyclopentyl]methyl]propan-2-amine
CID 81034843
2-bromo-N-methyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 102637295

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine?
The IUPAC name of N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine (CID 80999324) is N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine.
What is the SMILES notation for N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine?
The canonical SMILES for N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine is CC(C)CN(C)C1CCC1CNC(C)C.
What is the InChIKey of N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine?
The InChIKey is NSLNMBCLQMBSKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-10(2)9-15(5)13-7-6-12(13)8-14-11(3)4/h10-14H,6-9H2,1-5H3.
What are the key properties of N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine?
N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-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 N-methyl-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]cyclobutan-1-amine is sourced from PubChem (CID 80999324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).