2-cyclopentyl-1-(1-methylcyclopentyl)guanidine

C12H23N3 — CID 62369070

IUPAC2-cyclopentyl-1-(1-methylcyclopentyl)guanidine
SMILESCC1(N/C(N)=N/C2CCCC2)CCCC1
InChIInChI=1S/C12H23N3/c1-12(8-4-5-9-12)15-11(13)14-10-6-2-3-7-10/h10H,2-9H2,1H3,(H3,13,14,15)
InChIKeyCHAXRYOCONWQRX-UHFFFAOYSA-N
MW209.34 g/mol
LogP2.17
Rot. Bonds2

About 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine

2-cyclopentyl-1-(1-methylcyclopentyl)guanidine (PubChem CID 62369070) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine.

Molecular Properties

Compound Name2-cyclopentyl-1-(1-methylcyclopentyl)guanidine
PubChem CID62369070
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name2-cyclopentyl-1-(1-methylcyclopentyl)guanidine
SMILESCC1(N/C(N)=N/C2CCCC2)CCCC1
InChIInChI=1S/C12H23N3/c1-12(8-4-5-9-12)15-11(13)14-10-6-2-3-7-10/h10H,2-9H2,1H3,(H3,13,14,15)
InChIKeyCHAXRYOCONWQRX-UHFFFAOYSA-N
XLogP2.17
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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

1-(1-methylcyclohexyl)-2-propan-2-ylguanidine
CID 62380383
2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine
CID 62522328
2-cyclohexyl-1-(N'-cyclohexylcarbamimidoyl)guanidine
CID 68500912
2-cyclopentyl-1-methoxyguanidine
CID 130567773
1-amino-2-cyclohexylguanidine;hydrochloride
CID 91622736
N-amino-N'-cyclopentyl-1-methylcyclohexane-1-carboximidamide
CID 106828795
2-cyclohexyl-1-(5-methylhexan-2-yl)guanidine
CID 63925710
2-cyclohexyl-1-methylsulfonylguanidine
CID 130901012
cis-(1R,3S)-2,2-dimethyl-3-[(1-methylcyclohexyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 114092184
3-amino-3-hydroxyimino-N-(1-methylcyclopentyl)propanamide
CID 77051955
1-cyclopentyl-3-(1-methylcyclopentyl)thiourea
CID 116508968
2-[(2,2-dimethylcyclohexyl)amino]-N'-hydroxypropanimidamide
CID 79879008

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine?
The IUPAC name of 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine (CID 62369070) is 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine.
What is the SMILES notation for 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine?
The canonical SMILES for 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine is CC1(N/C(N)=N/C2CCCC2)CCCC1.
What is the InChIKey of 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine?
The InChIKey is CHAXRYOCONWQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-12(8-4-5-9-12)15-11(13)14-10-6-2-3-7-10/h10H,2-9H2,1H3,(H3,13,14,15).
What are the key properties of 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine?
2-cyclopentyl-1-(1-methylcyclopentyl)guanidine has a molecular weight of 209.34 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(1-methylcyclopentyl)guanidine is sourced from PubChem (CID 62369070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).