5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine

C13H27NO — CID 106205729

IUPAC5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine
SMILESCC(C)NCCCCCOCCC1CC1
InChIInChI=1S/C13H27NO/c1-12(2)14-9-4-3-5-10-15-11-8-13-6-7-13/h12-14H,3-11H2,1-2H3
InChIKeyMTQDRYCHUNTIJI-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.97
Rot. Bonds10

About 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine

5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine (PubChem CID 106205729) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine.

Molecular Properties

Compound Name5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine
PubChem CID106205729
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine
SMILESCC(C)NCCCCCOCCC1CC1
InChIInChI=1S/C13H27NO/c1-12(2)14-9-4-3-5-10-15-11-8-13-6-7-13/h12-14H,3-11H2,1-2H3
InChIKeyMTQDRYCHUNTIJI-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.97
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

5-(4-methylpentoxy)-N-propan-2-ylpentan-1-amine
CID 62457764
5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N-propan-2-ylpentan-1-amine
CID 104566618
5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-N-propan-2-ylpentan-1-amine
CID 112590039
4-pentoxy-N-propan-2-ylbutan-1-amine
CID 62449715
4-[2-(2-ethoxyethoxy)ethoxy]-N-propan-2-ylbutan-1-amine
CID 146693023
5-(4,4-dimethylcyclohexyl)oxy-N-propan-2-ylpentan-1-amine
CID 114342406
6-(2-cyclopropylethoxy)-N-methylhexan-2-amine
CID 106200767
5-(2-piperidin-1-ylethoxy)-N-propan-2-ylpentan-1-amine
CID 55076897
3-cyclotetradecyl-N-propan-2-ylpropan-1-amine
CID 91804535
2-cyclopropylethyl 3-(propan-2-ylamino)propanoate
CID 106202501
N-(2-decoxyethyl)propan-2-amine
CID 63399572
3-(cyclohexylmethoxy)-N-propan-2-ylpropan-1-amine
CID 62343201

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine?
The IUPAC name of 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine (CID 106205729) is 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine.
What is the SMILES notation for 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine?
The canonical SMILES for 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine is CC(C)NCCCCCOCCC1CC1.
What is the InChIKey of 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine?
The InChIKey is MTQDRYCHUNTIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-12(2)14-9-4-3-5-10-15-11-8-13-6-7-13/h12-14H,3-11H2,1-2H3.
What are the key properties of 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine?
5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine has a molecular weight of 213.36 g/mol, XLogP of 2.97, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine is sourced from PubChem (CID 106205729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).