N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine

C11H21NO — CID 103902883

IUPACN-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine
SMILESCC(NCC1(C)CC1)C1CCOC1
InChIInChI=1S/C11H21NO/c1-9(10-3-6-13-7-10)12-8-11(2)4-5-11/h9-10,12H,3-8H2,1-2H3
InChIKeyRDPFRXCUKVGYCN-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds4

About N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine

N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine (PubChem CID 103902883) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound NameN-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine
PubChem CID103902883
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine
SMILESCC(NCC1(C)CC1)C1CCOC1
InChIInChI=1S/C11H21NO/c1-9(10-3-6-13-7-10)12-8-11(2)4-5-11/h9-10,12H,3-8H2,1-2H3
InChIKeyRDPFRXCUKVGYCN-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-methylcyclopentyl)methyl]-1-(oxolan-3-yl)ethanamine
CID 115889581
N-[(2-methylthiolan-2-yl)methyl]-1-(oxolan-3-yl)ethanamine
CID 115728211
N,N-dimethyl-1-[[1-(oxolan-3-yl)ethylamino]methyl]cyclopentan-1-amine
CID 115707728
1-cyclopentyl-N-[(4-methyloxan-4-yl)methyl]ethanamine
CID 115893016
tert-butyl 3-methyl-3-[[1-(oxolan-3-yl)ethylamino]methyl]piperidine-1-carboxylate
CID 104537846
1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride
CID 115683928
1-[[1-(oxan-4-yl)ethylamino]methyl]cyclopentan-1-ol
CID 115719665
N-(oxan-3-ylmethyl)-1-(oxolan-3-yl)ethanamine
CID 115710912
1-(oxan-4-yl)-N-[1-(oxolan-3-yl)ethyl]ethanamine
CID 115724018
1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine
CID 115677339
(1S)-1-cycloheptyl-N-[(3-methyloxetan-3-yl)methyl]ethanamine
CID 81393158
[1-[[1-(oxan-4-yl)ethylamino]methyl]cyclohexyl]methanol
CID 103903221

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine?
The IUPAC name of N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine (CID 103902883) is N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine is CC(NCC1(C)CC1)C1CCOC1.
What is the InChIKey of N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine?
The InChIKey is RDPFRXCUKVGYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(10-3-6-13-7-10)12-8-11(2)4-5-11/h9-10,12H,3-8H2,1-2H3.
What are the key properties of N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine?
N-[(1-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine 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-methylcyclopropyl)methyl]-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 103902883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).