N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide

C14H25N3O — CID 122098985

IUPACN'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide
SMILESN/C(=N\CC1CCCC1C1CC1)N1CCOCC1
InChIInChI=1S/C14H25N3O/c15-14(17-6-8-18-9-7-17)16-10-12-2-1-3-13(12)11-4-5-11/h11-13H,1-10H2,(H2,15,16)
InChIKeyDADPTAATWHBDQD-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.46
Rot. Bonds3

About N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide

N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide (PubChem CID 122098985) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide.

Molecular Properties

Compound NameN'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide
PubChem CID122098985
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide
SMILESN/C(=N\CC1CCCC1C1CC1)N1CCOCC1
InChIInChI=1S/C14H25N3O/c15-14(17-6-8-18-9-7-17)16-10-12-2-1-3-13(12)11-4-5-11/h11-13H,1-10H2,(H2,15,16)
InChIKeyDADPTAATWHBDQD-UHFFFAOYSA-N
XLogP1.46
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-[(2-phenyloxan-3-yl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 111075066
N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide
CID 119118475
N'-(thian-4-ylmethyl)morpholine-4-carboximidamide;hydroiodide
CID 119146805
N'-[[1-(cyclohexylmethyl)pyrrolidin-2-yl]methyl]morpholine-4-carboximidamide;hydroiodide
CID 111807627
N'-[[(1R,2S)-2-cyclobutylcyclopropyl]methyl]-3-methylpiperidine-1-carboximidamide
CID 122125675
N'-[2-(2-bicyclo[2.2.1]heptanyl)ethyl]morpholine-4-carboximidamide;hydroiodide
CID 111072508
N'-[(3-methoxyoxan-4-yl)methyl]azepane-1-carboximidamide
CID 122097381
N'-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]thiomorpholine-4-carboximidamide
CID 122096518
N'-[2-[cyclohexyl(methyl)amino]ethyl]morpholine-4-carboximidamide
CID 111057268
N'-ethyl-1,4-oxazepane-4-carboximidamide
CID 62972618
N'-(2-cyclopentyloxyethyl)morpholine-4-carboximidamide
CID 99816286
N'-(3-cyclopropylpropyl)morpholine-4-carboximidamide
CID 111816668

Frequently Asked Questions

What is the IUPAC name of N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide?
The IUPAC name of N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide (CID 122098985) is N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide.
What is the SMILES notation for N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide?
The canonical SMILES for N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide is N/C(=N\CC1CCCC1C1CC1)N1CCOCC1.
What is the InChIKey of N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide?
The InChIKey is DADPTAATWHBDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c15-14(17-6-8-18-9-7-17)16-10-12-2-1-3-13(12)11-4-5-11/h11-13H,1-10H2,(H2,15,16).
What are the key properties of N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide?
N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide has a molecular weight of 251.37 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide is sourced from PubChem (CID 122098985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).