2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine

C10H21N3O — CID 62362509

IUPAC2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine
SMILESCOCCN(C)/C(N)=N/C1CCCC1
InChIInChI=1S/C10H21N3O/c1-13(7-8-14-2)10(11)12-9-5-3-4-6-9/h9H,3-8H2,1-2H3,(H2,11,12)
InChIKeyPRCMXYVVAKDGHQ-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.82
Rot. Bonds4

About 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine

2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine (PubChem CID 62362509) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine.

Molecular Properties

Compound Name2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine
PubChem CID62362509
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine
SMILESCOCCN(C)/C(N)=N/C1CCCC1
InChIInChI=1S/C10H21N3O/c1-13(7-8-14-2)10(11)12-9-5-3-4-6-9/h9H,3-8H2,1-2H3,(H2,11,12)
InChIKeyPRCMXYVVAKDGHQ-UHFFFAOYSA-N
XLogP0.82
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.82
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

2-Cyclopentyl-1-(2-methoxyethyl)-1-(2-methylpropyl)guanidine
CID 55063915
2-Cyclohexyl-1-(2-methoxyethyl)-1-(1-methoxypropan-2-yl)guanidine
CID 55064106
2-Cyclopentyl-1-(1-cyclopropylethyl)-1-(2-methoxyethyl)guanidine
CID 55064152
1-Butan-2-yl-1-(2-methoxyethyl)-2-methylguanidine
CID 62358412
1-(2-Methoxyethyl)-1-(1-methoxypropan-2-yl)-2-methylguanidine
CID 62358416
1-(2-Methoxyethyl)-2-methyl-1-pentan-3-ylguanidine
CID 62358418
1-Ethyl-1-(1-methoxypropan-2-yl)-2-methylguanidine
CID 62358600
1-(1-Methoxypropan-2-yl)-1,2-dimethylguanidine
CID 62360430
1-(2-Methoxyethyl)-1-pentan-3-yl-2-propylguanidine
CID 62361472
1-(2-Methoxyethyl)-1-pentan-3-yl-2-propan-2-ylguanidine
CID 62361473
2-Cyclopentyl-1,1-bis(2-methoxyethyl)guanidine
CID 62361629
2-Cyclopentyl-1-ethyl-1-(1-methoxypropan-2-yl)guanidine
CID 62361643

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine?
The IUPAC name of 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine (CID 62362509) is 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine.
What is the SMILES notation for 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine?
The canonical SMILES for 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine is COCCN(C)/C(N)=N/C1CCCC1.
What is the InChIKey of 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine?
The InChIKey is PRCMXYVVAKDGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-13(7-8-14-2)10(11)12-9-5-3-4-6-9/h9H,3-8H2,1-2H3,(H2,11,12).
What are the key properties of 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine?
2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine has a molecular weight of 199.30 g/mol, XLogP of 0.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine is sourced from PubChem (CID 62362509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).