N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine

C15H29NO — CID 114013911

IUPACN-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine
SMILESCCCC(C)C1(CNCC)CCOC1C1CC1
InChIInChI=1S/C15H29NO/c1-4-6-12(3)15(11-16-5-2)9-10-17-14(15)13-7-8-13/h12-14,16H,4-11H2,1-3H3
InChIKeyHGDOBFZXWCXXNA-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.22
Rot. Bonds7

About N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine

N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine (PubChem CID 114013911) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine
PubChem CID114013911
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine
SMILESCCCC(C)C1(CNCC)CCOC1C1CC1
InChIInChI=1S/C15H29NO/c1-4-6-12(3)15(11-16-5-2)9-10-17-14(15)13-7-8-13/h12-14,16H,4-11H2,1-3H3
InChIKeyHGDOBFZXWCXXNA-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)-N-methylmethanamine
CID 107897605
N-[(3-butan-2-yl-2-cyclopropyloxolan-3-yl)methyl]-2-methylpropan-2-amine
CID 113420879
3-butan-2-yl-3-(chloromethyl)-2-cyclopropyloxolane
CID 104510655
N-[(2-cyclopropyl-3-propan-2-yloxolan-3-yl)methyl]-2-methylpropan-2-amine
CID 104510040
3-(chloromethyl)-2-methyl-3-pentan-2-yloxolane
CID 107893311
N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine
CID 104509924
[2-cyclopropyl-3-(2-methylpentyl)oxolan-3-yl]methanol
CID 104510505
N-[[3-[(4-bromothiophen-2-yl)methyl]-2-cyclopropyloxolan-3-yl]methyl]ethanamine
CID 104509700
2-cyclopropyl-N-ethyl-3-methyloxolan-3-amine
CID 131155789
N-[[2-cyclopropyl-3-(1,1-dioxothiolan-3-yl)oxolan-3-yl]methyl]ethanamine
CID 104509669
1-[2-cyclopropyl-3-(3-methylbutyl)oxolan-3-yl]-N-methylmethanamine
CID 104509569
N-[(2-cyclopropyl-3-hexyloxolan-3-yl)methyl]propan-2-amine
CID 104509877

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine?
The IUPAC name of N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine (CID 114013911) is N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine.
What is the SMILES notation for N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine?
The canonical SMILES for N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine is CCCC(C)C1(CNCC)CCOC1C1CC1.
What is the InChIKey of N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine?
The InChIKey is HGDOBFZXWCXXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-4-6-12(3)15(11-16-5-2)9-10-17-14(15)13-7-8-13/h12-14,16H,4-11H2,1-3H3.
What are the key properties of N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine?
N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine has a molecular weight of 239.40 g/mol, XLogP of 3.22, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopropyl-3-pentan-2-yloxolan-3-yl)methyl]ethanamine is sourced from PubChem (CID 114013911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).