1-ethoxypropane;pentan-1-amine

C10H25NO — CID 174936602

IUPAC1-ethoxypropane;pentan-1-amine
SMILESCCCCCN.CCCOCC
InChIInChI=1S/C5H13N.C5H12O/c1-2-3-4-5-6;1-3-5-6-4-2/h2-6H2,1H3;3-5H2,1-2H3
InChIKeyQKPFUGCRHYUEPY-UHFFFAOYSA-N
MW175.32 g/mol
LogP2.57
Rot. Bonds6

About 1-ethoxypropane;pentan-1-amine

1-ethoxypropane;pentan-1-amine (PubChem CID 174936602) has the molecular formula C10H25NO and a molecular weight of 175.32 g/mol. Its IUPAC name is 1-ethoxypropane;pentan-1-amine.

Molecular Properties

Compound Name1-ethoxypropane;pentan-1-amine
PubChem CID174936602
Molecular FormulaC10H25NO
Molecular Weight175.32 g/mol
Exact Mass175.19
IUPAC Name1-ethoxypropane;pentan-1-amine
SMILESCCCCCN.CCCOCC
InChIInChI=1S/C5H13N.C5H12O/c1-2-3-4-5-6;1-3-5-6-4-2/h2-6H2,1H3;3-5H2,1-2H3
InChIKeyQKPFUGCRHYUEPY-UHFFFAOYSA-N
XLogP2.57
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.32
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-ethoxybutan-1-amine;hydrochloride
CID 87771260
4-(4-propoxybutoxy)butan-1-amine
CID 87914116
4-nonoxybutan-1-amine
CID 139664551
tridecan-1-amine;undecan-1-amine
CID 23045943
butane-1,4-diamine;hexan-1-amine
CID 162097736
decan-1-amine;hexan-1-amine
CID 162216125
hexacosan-1-amine
CID 14550481
1-ethoxypropane;methane
CID 158784820
dotetracontan-1-amine
CID 14550497
3-(4-ethoxybutoxy)propan-1-amine
CID 87914179
3-(15-dodecoxypentadecoxy)propan-1-amine
CID 87645067
3-(propoxymethoxy)propan-1-amine
CID 87914264

Frequently Asked Questions

What is the IUPAC name of 1-ethoxypropane;pentan-1-amine?
The IUPAC name of 1-ethoxypropane;pentan-1-amine (CID 174936602) is 1-ethoxypropane;pentan-1-amine.
What is the SMILES notation for 1-ethoxypropane;pentan-1-amine?
The canonical SMILES for 1-ethoxypropane;pentan-1-amine is CCCCCN.CCCOCC.
What is the InChIKey of 1-ethoxypropane;pentan-1-amine?
The InChIKey is QKPFUGCRHYUEPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C5H12O/c1-2-3-4-5-6;1-3-5-6-4-2/h2-6H2,1H3;3-5H2,1-2H3.
What are the key properties of 1-ethoxypropane;pentan-1-amine?
1-ethoxypropane;pentan-1-amine has a molecular weight of 175.32 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxypropane;pentan-1-amine is sourced from PubChem (CID 174936602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).