2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine

C14H29NO — CID 171719296

IUPAC2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CC(COC(C)(C)C)C1
InChIInChI=1S/C14H29NO/c1-13(2,3)15-9-11-7-12(8-11)10-16-14(4,5)6/h11-12,15H,7-10H2,1-6H3
InChIKeyUZRVLBDVBBXUCY-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.22
Rot. Bonds4

About 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine

2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine (PubChem CID 171719296) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine
PubChem CID171719296
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CC(COC(C)(C)C)C1
InChIInChI=1S/C14H29NO/c1-13(2,3)15-9-11-7-12(8-11)10-16-14(4,5)6/h11-12,15H,7-10H2,1-6H3
InChIKeyUZRVLBDVBBXUCY-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-methoxycyclobutyl)methyl]-2-methylpropan-2-amine
CID 106824564
N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane
CID 159032634
N-[[4-(aminomethyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 59867972
N-(cyclopent-3-en-1-ylmethyl)-2-methylpropan-2-amine
CID 65353678
(1S,2R,4R)-2-(tert-butylamino)-4-[(tert-butylamino)methyl]cyclopentan-1-ol
CID 137448966
2-methyl-N-[(1-methylazetidin-3-yl)methyl]propan-2-amine
CID 162784925
2-methyl-N-(4-tetracyclo[12.4.0.02,6.07,12]octadecanylmethyl)propan-2-amine
CID 59100363
1,3-dimethyl-5-[(2-methylpropan-2-yl)oxymethyl]-1,3-diazinane
CID 71100466
4-[(2-methylpropan-2-yl)oxymethyl]piperidine;hydrate
CID 144530470
N-[[2-(methoxymethyl)-4-propylcyclohexyl]methyl]-2-methylpropan-2-amine
CID 81030062
N,N-dimethyl-3-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine
CID 155794064
2-[4-[(tert-butylamino)methyl]piperidin-1-yl]propanenitrile
CID 63848785

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine (CID 171719296) is 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine is CC(C)(C)NCC1CC(COC(C)(C)C)C1.
What is the InChIKey of 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine?
The InChIKey is UZRVLBDVBBXUCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-13(2,3)15-9-11-7-12(8-11)10-16-14(4,5)6/h11-12,15H,7-10H2,1-6H3.
What are the key properties of 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine?
2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine has a molecular weight of 227.39 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]propan-2-amine is sourced from PubChem (CID 171719296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).