2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine

C10H19N3O — CID 62522328

IUPAC2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine
SMILESN/C(=N\C1CC1)NC1(CO)CCCC1
InChIInChI=1S/C10H19N3O/c11-9(12-8-3-4-8)13-10(7-14)5-1-2-6-10/h8,14H,1-7H2,(H3,11,12,13)
InChIKeyNFATYVZCRZBRRN-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.36
Rot. Bonds3

About 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine

2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine (PubChem CID 62522328) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine.

Molecular Properties

Compound Name2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine
PubChem CID62522328
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine
SMILESN/C(=N\C1CC1)NC1(CO)CCCC1
InChIInChI=1S/C10H19N3O/c11-9(12-8-3-4-8)13-10(7-14)5-1-2-6-10/h8,14H,1-7H2,(H3,11,12,13)
InChIKeyNFATYVZCRZBRRN-UHFFFAOYSA-N
XLogP0.36
TPSA70.64 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.36
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine?
The IUPAC name of 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine (CID 62522328) is 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine.
What is the SMILES notation for 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine?
The canonical SMILES for 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine is N/C(=N\C1CC1)NC1(CO)CCCC1.
What is the InChIKey of 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine?
The InChIKey is NFATYVZCRZBRRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c11-9(12-8-3-4-8)13-10(7-14)5-1-2-6-10/h8,14H,1-7H2,(H3,11,12,13).
What are the key properties of 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine?
2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine has a molecular weight of 197.28 g/mol, XLogP of 0.36, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-[1-(hydroxymethyl)cyclopentyl]guanidine is sourced from PubChem (CID 62522328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).