1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine

C10H19N3O — CID 130491764

IUPAC1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine
SMILESCC1COCCC1/N=C(\N)NC1CC1
InChIInChI=1S/C10H19N3O/c1-7-6-14-5-4-9(7)13-10(11)12-8-2-3-8/h7-9H,2-6H2,1H3,(H3,11,12,13)
InChIKeyNFCBQMLIPMZPKX-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.48
Rot. Bonds2

About 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine

1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine (PubChem CID 130491764) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine.

Molecular Properties

Compound Name1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine
PubChem CID130491764
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine
SMILESCC1COCCC1/N=C(\N)NC1CC1
InChIInChI=1S/C10H19N3O/c1-7-6-14-5-4-9(7)13-10(11)12-8-2-3-8/h7-9H,2-6H2,1H3,(H3,11,12,13)
InChIKeyNFCBQMLIPMZPKX-UHFFFAOYSA-N
XLogP0.48
TPSA59.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(diaminomethylidene)-2-(3-methyloxan-4-yl)guanidine
CID 130491765
1-cyclopropyl-2-(2,3-dimethylcyclobutyl)guanidine
CID 130993715
1-cyclopropyl-2-(oxan-4-yl)guanidine
CID 62361761
1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine
CID 115600959
N'-(4-methyloxolan-3-yl)ethanimidamide
CID 170275954
2-ethyl-1-(oxan-4-yl)guanidine
CID 62361758
(3S)-4-azido-3-methyloxane
CID 139456410
1-cyclopropyl-2-(1-methyl-2-oxopyrrolidin-3-yl)guanidine
CID 106257207
1-cyclopentyl-2-(2-propan-2-ylcyclohexyl)guanidine
CID 78965822
1-cyclopropyl-2-[(2-methylcyclopropyl)methyl]guanidine
CID 115600994
1-cyclopentyl-2-(2-methoxycyclopentyl)guanidine
CID 62362535
1-cycloheptyl-2-[(1R,2S)-2-cyclopropylcyclopropyl]guanidine
CID 122082390

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine?
The IUPAC name of 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine (CID 130491764) is 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine.
What is the SMILES notation for 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine?
The canonical SMILES for 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine is CC1COCCC1/N=C(\N)NC1CC1.
What is the InChIKey of 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine?
The InChIKey is NFCBQMLIPMZPKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-7-6-14-5-4-9(7)13-10(11)12-8-2-3-8/h7-9H,2-6H2,1H3,(H3,11,12,13).
What are the key properties of 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine?
1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine has a molecular weight of 197.28 g/mol, XLogP of 0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine is sourced from PubChem (CID 130491764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).