N-amino-N'-cyclopropylcyclopentanecarboximidamide

C9H17N3 — CID 61362316

IUPACN-amino-N'-cyclopropylcyclopentanecarboximidamide
SMILESNN/C(=N\C1CC1)C1CCCC1
InChIInChI=1S/C9H17N3/c10-12-9(11-8-5-6-8)7-3-1-2-4-7/h7-8H,1-6,10H2,(H,11,12)
InChIKeyKYBXANFCBHHDAC-UHFFFAOYSA-N
MW167.26 g/mol
LogP1.20
Rot. Bonds2

About N-amino-N'-cyclopropylcyclopentanecarboximidamide

N-amino-N'-cyclopropylcyclopentanecarboximidamide (PubChem CID 61362316) has the molecular formula C9H17N3 and a molecular weight of 167.26 g/mol. Its IUPAC name is N-amino-N'-cyclopropylcyclopentanecarboximidamide.

Molecular Properties

Compound NameN-amino-N'-cyclopropylcyclopentanecarboximidamide
PubChem CID61362316
Molecular FormulaC9H17N3
Molecular Weight167.26 g/mol
Exact Mass167.14
IUPAC NameN-amino-N'-cyclopropylcyclopentanecarboximidamide
SMILESNN/C(=N\C1CC1)C1CCCC1
InChIInChI=1S/C9H17N3/c10-12-9(11-8-5-6-8)7-3-1-2-4-7/h7-8H,1-6,10H2,(H,11,12)
InChIKeyKYBXANFCBHHDAC-UHFFFAOYSA-N
XLogP1.20
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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CID 55194306
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N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide
CID 164652475
N-amino-N'-cyclohexyloxolane-2-carboximidamide
CID 61363503
N-amino-N'-cyclopentyltricyclo[3.2.1.02,4]octane-3-carboximidamide
CID 114097163
N-amino-N'-tert-butylcycloheptanecarboximidamide
CID 62590760
N-amino-N'-ethylcyclooctanecarboximidamide
CID 65020858
N-amino-N'-cyclohexyladamantane-2-carboximidamide
CID 81098708
1-amino-2-cyclohexylguanidine;hydrochloride
CID 91622736
N-amino-2-cycloheptyl-N'-cyclopropylethanimidamide
CID 104928915
N-amino-N'-cyclohexylpropanimidamide
CID 61363512
N-amino-N'-cyclopentyl-2,3-dihydro-1-benzothiophene-3-carboximidamide
CID 79212455

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-cyclopropylcyclopentanecarboximidamide?
The IUPAC name of N-amino-N'-cyclopropylcyclopentanecarboximidamide (CID 61362316) is N-amino-N'-cyclopropylcyclopentanecarboximidamide.
What is the SMILES notation for N-amino-N'-cyclopropylcyclopentanecarboximidamide?
The canonical SMILES for N-amino-N'-cyclopropylcyclopentanecarboximidamide is NN/C(=N\C1CC1)C1CCCC1.
What is the InChIKey of N-amino-N'-cyclopropylcyclopentanecarboximidamide?
The InChIKey is KYBXANFCBHHDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3/c10-12-9(11-8-5-6-8)7-3-1-2-4-7/h7-8H,1-6,10H2,(H,11,12).
What are the key properties of N-amino-N'-cyclopropylcyclopentanecarboximidamide?
N-amino-N'-cyclopropylcyclopentanecarboximidamide has a molecular weight of 167.26 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-cyclopropylcyclopentanecarboximidamide is sourced from PubChem (CID 61362316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).