(3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine

C14H31N3O — CID 105242101

IUPAC(3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine
SMILESCCCOCC(NN)C(CC)(CC)N1CCCC1
InChIInChI=1S/C14H31N3O/c1-4-11-18-12-13(16-15)14(5-2,6-3)17-9-7-8-10-17/h13,16H,4-12,15H2,1-3H3
InChIKeyNDAIIVYPVMFULR-UHFFFAOYSA-N
MW257.42 g/mol
LogP1.90
Rot. Bonds9

About (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine

(3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine (PubChem CID 105242101) has the molecular formula C14H31N3O and a molecular weight of 257.42 g/mol. Its IUPAC name is (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine.

Molecular Properties

Compound Name(3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine
PubChem CID105242101
Molecular FormulaC14H31N3O
Molecular Weight257.42 g/mol
Exact Mass257.25
IUPAC Name(3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine
SMILESCCCOCC(NN)C(CC)(CC)N1CCCC1
InChIInChI=1S/C14H31N3O/c1-4-11-18-12-13(16-15)14(5-2,6-3)17-9-7-8-10-17/h13,16H,4-12,15H2,1-3H3
InChIKeyNDAIIVYPVMFULR-UHFFFAOYSA-N
XLogP1.90
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3-methyl-3-piperidin-1-yl-1-propoxypentan-2-yl)hydrazine
CID 105241264
3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-ol
CID 79573999
N-ethyl-3-methyl-3-piperidin-1-yl-1-propoxybutan-2-amine
CID 79574688
(4-ethyl-2,2-dimethyl-4-pyrrolidin-1-ylhexan-3-yl)hydrazine
CID 105242234
[1-(2-bromophenyl)-3-ethyl-3-pyrrolidin-1-ylpentan-2-yl]hydrazine
CID 105242253
(1-cyclopentyl-2-ethyl-2-pyrrolidin-1-ylbutyl)hydrazine
CID 105242115
[3-ethyl-1-(2-methyl-1,2,4-triazol-3-yl)-3-pyrrolidin-1-ylpentan-2-yl]hydrazine
CID 105242143
1-cyclobutyl-3-ethyl-N-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79067520
3-ethyl-N,7-dimethyl-3-pyrrolidin-1-yloctan-4-amine
CID 79067196
(3-methyl-3-piperidin-1-yloctan-4-yl)hydrazine
CID 105241246
(1,1-difluoro-3-propoxypropan-2-yl)hydrazine
CID 105264981
(4,4,4-trifluoro-1-propoxybutan-2-yl)hydrazine
CID 105205872

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine?
The IUPAC name of (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine (CID 105242101) is (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine.
What is the SMILES notation for (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine?
The canonical SMILES for (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine is CCCOCC(NN)C(CC)(CC)N1CCCC1.
What is the InChIKey of (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine?
The InChIKey is NDAIIVYPVMFULR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O/c1-4-11-18-12-13(16-15)14(5-2,6-3)17-9-7-8-10-17/h13,16H,4-12,15H2,1-3H3.
What are the key properties of (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine?
(3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine has a molecular weight of 257.42 g/mol, XLogP of 1.90, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-1-propoxy-3-pyrrolidin-1-ylpentan-2-yl)hydrazine is sourced from PubChem (CID 105242101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).