cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine

C9H19N5 — CID 171101243

IUPACcyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine
SMILESNC1CCCC1.[H]/N=C(C)/C=N\C(N)=N\[H]
InChIInChI=1S/C5H11N.C4H8N4/c6-5-3-1-2-4-5;1-3(5)2-8-4(6)7/h5H,1-4,6H2;2,5H,1H3,(H3,6,7)/b;5-3+,8-2-
InChIKeyKFPYSRPWEXMJCB-RDQMYXQQSA-N
MW197.29 g/mol
LogP0.88
Rot. Bonds1

About cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine

cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine (PubChem CID 171101243) has the molecular formula C9H19N5 and a molecular weight of 197.29 g/mol. Its IUPAC name is cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine.

Molecular Properties

Compound Namecyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine
PubChem CID171101243
Molecular FormulaC9H19N5
Molecular Weight197.29 g/mol
Exact Mass197.16
IUPAC Namecyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine
SMILESNC1CCCC1.[H]/N=C(C)/C=N\C(N)=N\[H]
InChIInChI=1S/C5H11N.C4H8N4/c6-5-3-1-2-4-5;1-3(5)2-8-4(6)7/h5H,1-4,6H2;2,5H,1H3,(H3,6,7)/b;5-3+,8-2-
InChIKeyKFPYSRPWEXMJCB-RDQMYXQQSA-N
XLogP0.88
TPSA112.10 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.29
LogP ≤ 50.88
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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

N-(2-iminopropylidene)cycloheptanecarboximidamide
CID 155056687
1-[(E)-2-oxopent-3-enylidene]guanidine
CID 123227345
1-N-(1-cyclopropylethyl)propane-1,2-diimine
CID 123669963
2-carbamimidoyl-1-(cyclopentylmethyl)-1-methylguanidine
CID 176547026
CID 175698442
CID 175698442
azane;cyclopentanamine
CID 69254255
cyclopentanamine;platinum(2+)
CID 21144800
N-cyclopentyl-N-methylethanimidamide
CID 63173127
cyclopentane;ethanimidamide
CID 158057030
2-carbamimidoyl-1-cyclohexyl-1-methylguanidine;hydrochloride
CID 176518469
cyclohexanamine;ethanol
CID 159108869
N'-carbamimidoylethanimidamide
CID 20603119

Frequently Asked Questions

What is the IUPAC name of cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine?
The IUPAC name of cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine (CID 171101243) is cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine.
What is the SMILES notation for cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine?
The canonical SMILES for cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine is NC1CCCC1.[H]/N=C(C)/C=N\C(N)=N\[H].
What is the InChIKey of cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine?
The InChIKey is KFPYSRPWEXMJCB-RDQMYXQQSA-N. The full InChI is InChI=1S/C5H11N.C4H8N4/c6-5-3-1-2-4-5;1-3(5)2-8-4(6)7/h5H,1-4,6H2;2,5H,1H3,(H3,6,7)/b;5-3+,8-2-.
What are the key properties of cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine?
cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine has a molecular weight of 197.29 g/mol, XLogP of 0.88, 1 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentanamine;(1Z)-1-(2-iminopropylidene)guanidine is sourced from PubChem (CID 171101243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).