2-[(2,2-dimethylcyclopentylidene)amino]guanidine

C8H16N4 — CID 79821865

IUPAC2-[(2,2-dimethylcyclopentylidene)amino]guanidine
SMILESCC1(C)CCCC1=NN=C(N)N
InChIInChI=1S/C8H16N4/c1-8(2)5-3-4-6(8)11-12-7(9)10/h3-5H2,1-2H3,(H4,9,10,12)
InChIKeyRPYRAYRARNCPKE-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.83
Rot. Bonds1

About 2-[(2,2-dimethylcyclopentylidene)amino]guanidine

2-[(2,2-dimethylcyclopentylidene)amino]guanidine (PubChem CID 79821865) has the molecular formula C8H16N4 and a molecular weight of 168.24 g/mol. Its IUPAC name is 2-[(2,2-dimethylcyclopentylidene)amino]guanidine.

Molecular Properties

Compound Name2-[(2,2-dimethylcyclopentylidene)amino]guanidine
PubChem CID79821865
Molecular FormulaC8H16N4
Molecular Weight168.24 g/mol
Exact Mass168.14
IUPAC Name2-[(2,2-dimethylcyclopentylidene)amino]guanidine
SMILESCC1(C)CCCC1=NN=C(N)N
InChIInChI=1S/C8H16N4/c1-8(2)5-3-4-6(8)11-12-7(9)10/h3-5H2,1-2H3,(H4,9,10,12)
InChIKeyRPYRAYRARNCPKE-UHFFFAOYSA-N
XLogP0.83
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.83
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'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(3,3-dimethylcyclohexylidene)amino]guanidine
CID 77060123
[(2,2-dimethylcyclopentylidene)amino]thiourea
CID 79863322
2-[(3,3-dimethylcyclopentylidene)amino]guanidine
CID 80699384
2-[(E)-[(Z)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylidene]amino]guanidine
CID 92533713
2-(cyclododecylideneamino)guanidine
CID 2817436
2-[(E)-(2,2-dimethylcyclopentylidene)amino]oxyacetic acid
CID 126972582
4,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalene
CID 71441384
2-[(Z)-(2-cyclohexylidenecyclohexylidene)amino]guanidine
CID 123941310
2-[(4-tert-butylcycloheptylidene)amino]guanidine
CID 77060035
(NE)-N-[(5R,6S)-4,4,5-trimethylspiro[1,2,3,5,7,8-hexahydronaphthalene-6,2'-cyclopentane]-1'-ylidene]hydroxylamine
CID 134971211
N-(diaminomethylidene)-2,8,8-trimethyl-6,7-dihydro-5H-quinoline-3-carboxamide
CID 21186755
(2E)-2-ethylidene-3,3-dimethylcyclohexan-1-one
CID 24976474

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethylcyclopentylidene)amino]guanidine?
The IUPAC name of 2-[(2,2-dimethylcyclopentylidene)amino]guanidine (CID 79821865) is 2-[(2,2-dimethylcyclopentylidene)amino]guanidine.
What is the SMILES notation for 2-[(2,2-dimethylcyclopentylidene)amino]guanidine?
The canonical SMILES for 2-[(2,2-dimethylcyclopentylidene)amino]guanidine is CC1(C)CCCC1=NN=C(N)N.
What is the InChIKey of 2-[(2,2-dimethylcyclopentylidene)amino]guanidine?
The InChIKey is RPYRAYRARNCPKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4/c1-8(2)5-3-4-6(8)11-12-7(9)10/h3-5H2,1-2H3,(H4,9,10,12).
What are the key properties of 2-[(2,2-dimethylcyclopentylidene)amino]guanidine?
2-[(2,2-dimethylcyclopentylidene)amino]guanidine has a molecular weight of 168.24 g/mol, XLogP of 0.83, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethylcyclopentylidene)amino]guanidine is sourced from PubChem (CID 79821865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).