N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine

C10H17NO — CID 62567244

IUPACN-(2-cyclopentyloxyethyl)prop-2-yn-1-amine
SMILESC#CCNCCOC1CCCC1
InChIInChI=1S/C10H17NO/c1-2-7-11-8-9-12-10-5-3-4-6-10/h1,10-11H,3-9H2
InChIKeyLIEPLQOOJIHHLU-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.17
Rot. Bonds5

About N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine

N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine (PubChem CID 62567244) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)prop-2-yn-1-amine
PubChem CID62567244
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC NameN-(2-cyclopentyloxyethyl)prop-2-yn-1-amine
SMILESC#CCNCCOC1CCCC1
InChIInChI=1S/C10H17NO/c1-2-7-11-8-9-12-10-5-3-4-6-10/h1,10-11H,3-9H2
InChIKeyLIEPLQOOJIHHLU-UHFFFAOYSA-N
XLogP1.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-cyclopentyloxyethyl)-2-methoxyethanamine
CID 62564778
1-(2-cyclopentyloxyethyl)-2-methyl-3-prop-2-ynylguanidine
CID 119149140
N-(3-cyclohexyloxypropyl)-2-(prop-2-ynylamino)acetamide
CID 79286966
N-(2-cyclopentyloxyethyl)-2,2-dimethylpropan-1-amine
CID 63001166
2-cyclopentyloxy-N-(2-propan-2-yloxyethyl)ethanamine
CID 63826960
N-(2-cyclopentyloxyethyl)hexan-1-amine
CID 62567442
N-(2-cyclohexyloxyethyl)pent-3-yn-1-amine
CID 104806928
1-(2-cyclopentyloxyethylamino)-2-methylpropan-2-ol
CID 63826434
N-(2-cyclohexyloxyethyl)-3-methoxypropan-1-amine
CID 62567637
3-(2-cyclohexyloxyethylamino)propanenitrile
CID 63828223
N-(2-cycloheptyloxyethyl)pentan-1-amine
CID 62584222
4-(2-cyclopentyloxyethylamino)butanenitrile
CID 63827839

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine?
The IUPAC name of N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine (CID 62567244) is N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine?
The canonical SMILES for N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine is C#CCNCCOC1CCCC1.
What is the InChIKey of N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine?
The InChIKey is LIEPLQOOJIHHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-2-7-11-8-9-12-10-5-3-4-6-10/h1,10-11H,3-9H2.
What are the key properties of N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine?
N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine has a molecular weight of 167.25 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyethyl)prop-2-yn-1-amine is sourced from PubChem (CID 62567244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).