1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine

C11H19N5 — CID 62369717

IUPAC1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine
SMILESCc1[nH]ncc1C/N=C(\N)NC1CCCC1
InChIInChI=1S/C11H19N5/c1-8-9(7-14-16-8)6-13-11(12)15-10-4-2-3-5-10/h7,10H,2-6H2,1H3,(H,14,16)(H3,12,13,15)
InChIKeyBCZCWXCZDIUNGP-UHFFFAOYSA-N
MW221.31 g/mol
LogP1.07
Rot. Bonds3

About 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine

1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine (PubChem CID 62369717) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine.

Molecular Properties

Compound Name1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine
PubChem CID62369717
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC Name1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine
SMILESCc1[nH]ncc1C/N=C(\N)NC1CCCC1
InChIInChI=1S/C11H19N5/c1-8-9(7-14-16-8)6-13-11(12)15-10-4-2-3-5-10/h7,10H,2-6H2,1H3,(H,14,16)(H3,12,13,15)
InChIKeyBCZCWXCZDIUNGP-UHFFFAOYSA-N
XLogP1.07
TPSA79.09 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 51.07
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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Related Compounds

2-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-propan-2-ylguanidine
CID 62363317
N'-[(5-methyl-1H-pyrazol-4-yl)methyl]cyclopropanecarboximidamide
CID 63178022
1-cyclopropyl-2-[(3-methyl-4-pyridinyl)methyl]guanidine
CID 114700716
1-cyclopentyl-2-[[2-(methylsulfonylmethyl)phenyl]methyl]guanidine
CID 119146547
1-cyclohexyl-2-(2H-tetrazol-5-ylmethyl)guanidine
CID 19866588
1-cyclopropyl-2-[(2-methylphenyl)methyl]guanidine
CID 62364183
1-cyclopentyl-2-[(5-methylfuran-2-yl)methyl]guanidine
CID 62525249
1-amino-3-cyclopropyl-2-[3-(5-methyl-1H-pyrazol-4-yl)propyl]guanidine
CID 104884313
1-(cyclobutylmethyl)-3-ethyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine
CID 119151385
1-cycloheptyl-2-[(4-methyl-2-pyridinyl)methyl]guanidine
CID 122096466
1-cyclohexyl-2-[(5-fluoro-2-pyridinyl)methyl]guanidine;hydroiodide
CID 119164307
1-cyclohexyl-2-[(2,6-dimethylpyrimidin-4-yl)methyl]guanidine
CID 120913740

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine?
The IUPAC name of 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine (CID 62369717) is 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine.
What is the SMILES notation for 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine?
The canonical SMILES for 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine is Cc1[nH]ncc1C/N=C(\N)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine?
The InChIKey is BCZCWXCZDIUNGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c1-8-9(7-14-16-8)6-13-11(12)15-10-4-2-3-5-10/h7,10H,2-6H2,1H3,(H,14,16)(H3,12,13,15).
What are the key properties of 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine?
1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine has a molecular weight of 221.31 g/mol, XLogP of 1.07, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-[(5-methyl-1H-pyrazol-4-yl)methyl]guanidine is sourced from PubChem (CID 62369717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).