N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine

C13H26N2O — CID 82734585

IUPACN-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine
SMILESCCC1CCC(CN)(N(C)C2CCOC2)C1
InChIInChI=1S/C13H26N2O/c1-3-11-4-6-13(8-11,10-14)15(2)12-5-7-16-9-12/h11-12H,3-10,14H2,1-2H3
InChIKeyRQGMRTTVBMNVMD-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.61
Rot. Bonds4

About N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine

N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine (PubChem CID 82734585) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine
PubChem CID82734585
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine
SMILESCCC1CCC(CN)(N(C)C2CCOC2)C1
InChIInChI=1S/C13H26N2O/c1-3-11-4-6-13(8-11,10-14)15(2)12-5-7-16-9-12/h11-12H,3-10,14H2,1-2H3
InChIKeyRQGMRTTVBMNVMD-UHFFFAOYSA-N
XLogP1.61
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine
CID 106822250
4-(aminomethyl)-1-ethyl-N-methyl-N-(oxolan-3-yl)piperidin-4-amine
CID 82735423
4-(aminomethyl)-N,1,2-trimethyl-N-(oxolan-3-yl)piperidin-4-amine
CID 82734229
N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyl-1,1-dioxothiolan-3-amine
CID 64501186
N-[3-(aminomethyl)-1,1-dioxothiolan-3-yl]-N-methyloxolan-3-amine
CID 82734241
1-(aminomethyl)-N,4-diethyl-N-(oxolan-3-ylmethyl)cyclohexan-1-amine
CID 62009915
1-(aminomethyl)-N,N-bis(cyclopropylmethyl)-3-ethylcyclopentan-1-amine
CID 64500122
N-[1-(aminomethyl)cyclohexyl]-N-methyloxan-4-amine
CID 43610982
1-(aminomethyl)-4-ethyl-N,N-dimethylcyclohexan-1-amine
CID 24692899
1-(aminomethyl)-3-ethyl-N-methyl-N-pentylcyclopentan-1-amine
CID 64500961
2-N-[1-(aminomethyl)-3-ethylcyclopentyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103188191
N-[1-(aminomethyl)-4-ethylcyclohexyl]-N-methyl-1,1-dioxothiolan-3-amine
CID 43648656

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine?
The IUPAC name of N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine (CID 82734585) is N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine.
What is the SMILES notation for N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine?
The canonical SMILES for N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine is CCC1CCC(CN)(N(C)C2CCOC2)C1.
What is the InChIKey of N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine?
The InChIKey is RQGMRTTVBMNVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-11-4-6-13(8-11,10-14)15(2)12-5-7-16-9-12/h11-12H,3-10,14H2,1-2H3.
What are the key properties of N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine?
N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine has a molecular weight of 226.36 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine is sourced from PubChem (CID 82734585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).