4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine

C14H30N2O — CID 103392020

IUPAC4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine
SMILESCCC1CCCCCN1C(CCCN)COC
InChIInChI=1S/C14H30N2O/c1-3-13-8-5-4-6-11-16(13)14(12-17-2)9-7-10-15/h13-14H,3-12,15H2,1-2H3
InChIKeyUYTWVFHPFCZHSD-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.39
Rot. Bonds7

About 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine

4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine (PubChem CID 103392020) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine.

Molecular Properties

Compound Name4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine
PubChem CID103392020
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine
SMILESCCC1CCCCCN1C(CCCN)COC
InChIInChI=1S/C14H30N2O/c1-3-13-8-5-4-6-11-16(13)14(12-17-2)9-7-10-15/h13-14H,3-12,15H2,1-2H3
InChIKeyUYTWVFHPFCZHSD-UHFFFAOYSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-4-piperidin-1-ylpentan-1-amine
CID 103391620
5-methoxy-4-(2-propan-2-ylpyrrolidin-1-yl)pentan-1-amine
CID 103391948
N-[2-(2-ethylazepan-1-yl)-3-methoxypropyl]-2-methylpropan-1-amine
CID 103227231
2-(2-ethylpiperidin-1-yl)nonan-1-amine
CID 43266376
4-(2-ethylpyrrolidin-1-yl)pentan-1-amine
CID 62437661
N-[2-(2-ethylpyrrolidin-1-yl)-3-methoxypropyl]cyclopropanamine
CID 103225163
4-(4-tert-butylazepan-1-yl)-5-methoxypentan-1-amine
CID 103391933
3-amino-2-(2-ethylpiperidin-1-yl)propan-1-ol
CID 104710817
2-(2-ethylazepan-1-yl)-4,4-dimethylpentan-1-amine
CID 104689222
2-(2-ethylpyrrolidin-1-yl)pentan-1-amine
CID 60974673
3-methoxy-N-methyl-2-(2-propylpiperidin-1-yl)propan-1-amine
CID 103227164
5-methoxy-4-(4-propylpiperazin-1-yl)pentan-1-amine
CID 103391626

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine?
The IUPAC name of 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine (CID 103392020) is 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine.
What is the SMILES notation for 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine?
The canonical SMILES for 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine is CCC1CCCCCN1C(CCCN)COC.
What is the InChIKey of 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine?
The InChIKey is UYTWVFHPFCZHSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-3-13-8-5-4-6-11-16(13)14(12-17-2)9-7-10-15/h13-14H,3-12,15H2,1-2H3.
What are the key properties of 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine?
4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylazepan-1-yl)-5-methoxypentan-1-amine is sourced from PubChem (CID 103392020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).