N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine

C11H21NO — CID 115887835

IUPACN-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine
SMILESCC1(CNCC2CCOC2)CCC1
InChIInChI=1S/C11H21NO/c1-11(4-2-5-11)9-12-7-10-3-6-13-8-10/h10,12H,2-9H2,1H3
InChIKeyCNGYXOSYDVZJHL-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds4

About N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine

N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine (PubChem CID 115887835) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine.

Molecular Properties

Compound NameN-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine
PubChem CID115887835
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine
SMILESCC1(CNCC2CCOC2)CCC1
InChIInChI=1S/C11H21NO/c1-11(4-2-5-11)9-12-7-10-3-6-13-8-10/h10,12H,2-9H2,1H3
InChIKeyCNGYXOSYDVZJHL-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-ethylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine
CID 115887846
1-[(oxolan-3-ylmethylamino)methyl]cyclopropan-1-amine
CID 65457971
1-cyclopentyl-N-[(1-methylcyclopentyl)methyl]methanamine
CID 63822365
N-[[1-(chloromethyl)cyclohexyl]methyl]-1-(oxolan-3-yl)methanamine
CID 103969185
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-(oxolan-3-yl)methanamine
CID 115438163
1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine
CID 103724422
N,N,3-trimethyl-1-[(oxolan-3-ylmethylamino)methyl]cyclohexan-1-amine
CID 61211546
3,3-dimethyl-1-(oxolan-3-ylmethylamino)butan-2-ol
CID 115887516
N-(oxolan-3-ylmethyl)propan-1-amine
CID 22355248
N-[(1-methylcyclobutyl)methyl]-1-(oxolan-2-yl)methanamine
CID 106813007
4-hydroxy-4-[(oxolan-3-ylmethylamino)methyl]cyclohexane-1-carboxylic acid
CID 106499198
N-[(1-methoxycyclobutyl)methyl]-1-(oxan-4-yl)methanamine
CID 103991529

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine?
The IUPAC name of N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine (CID 115887835) is N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine.
What is the SMILES notation for N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine?
The canonical SMILES for N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine is CC1(CNCC2CCOC2)CCC1.
What is the InChIKey of N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine?
The InChIKey is CNGYXOSYDVZJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(4-2-5-11)9-12-7-10-3-6-13-8-10/h10,12H,2-9H2,1H3.
What are the key properties of N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine?
N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine has a molecular weight of 183.29 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine is sourced from PubChem (CID 115887835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).