3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide

C10H22N4O — CID 105418384

IUPAC3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide
SMILESCN(C)C1(CNCCC(N)=NO)CCC1
InChIInChI=1S/C10H22N4O/c1-14(2)10(5-3-6-10)8-12-7-4-9(11)13-15/h12,15H,3-8H2,1-2H3,(H2,11,13)
InChIKeyOZEAVWDMAYOTTG-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.20
Rot. Bonds6

About 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide

3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide (PubChem CID 105418384) has the molecular formula C10H22N4O and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide.

Molecular Properties

Compound Name3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide
PubChem CID105418384
Molecular FormulaC10H22N4O
Molecular Weight214.31 g/mol
Exact Mass214.18
IUPAC Name3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide
SMILESCN(C)C1(CNCCC(N)=NO)CCC1
InChIInChI=1S/C10H22N4O/c1-14(2)10(5-3-6-10)8-12-7-4-9(11)13-15/h12,15H,3-8H2,1-2H3,(H2,11,13)
InChIKeyOZEAVWDMAYOTTG-UHFFFAOYSA-N
XLogP0.20
TPSA73.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[[[1-(dimethylamino)cyclobutyl]methylamino]methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide
CID 103370244
2-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide
CID 103370245
3-[2-[di(propan-2-yl)amino]ethylamino]-N'-hydroxypentanimidamide
CID 64326774
3-[2-[cyclopentyl(methyl)amino]ethylamino]-N'-hydroxy-2-methylpropanimidamide
CID 64329262
2-[cyclobutylmethyl(methyl)amino]-N'-hydroxypropanimidamide
CID 76950900
2-[cyclobutylmethyl(methyl)amino]-N'-hydroxybutanimidamide
CID 76950901
N'-hydroxy-5-(2-methylbutan-2-ylamino)pentanimidamide
CID 77025525
5-[2-[di(propan-2-yl)amino]ethylamino]-N'-hydroxypentanimidamide
CID 77025540
N'-hydroxy-3-(2-methylbutan-2-ylamino)pentanimidamide
CID 77025653
3-[2-[di(propan-2-yl)amino]ethylamino]-N'-hydroxypentanimidamide
CID 77025667
5-[2-(diethylamino)ethylamino]-N'-hydroxypentanimidamide
CID 77026354
3-[2-(diethylamino)ethylamino]-N'-hydroxypentanimidamide
CID 77026355

Frequently Asked Questions

What is the IUPAC name of 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide?
The IUPAC name of 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide (CID 105418384) is 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide.
What is the SMILES notation for 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide?
The canonical SMILES for 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide is CN(C)C1(CNCCC(N)=NO)CCC1.
What is the InChIKey of 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide?
The InChIKey is OZEAVWDMAYOTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O/c1-14(2)10(5-3-6-10)8-12-7-4-9(11)13-15/h12,15H,3-8H2,1-2H3,(H2,11,13).
What are the key properties of 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide?
3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide has a molecular weight of 214.31 g/mol, XLogP of 0.20, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide is sourced from PubChem (CID 105418384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).