1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide

C15H25N5 — CID 64783767

IUPAC1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide
SMILES[H]/N=C(\N)C1CCN(Cc2ccn(C3CCCC3)n2)CC1
InChIInChI=1S/C15H25N5/c16-15(17)12-5-8-19(9-6-12)11-13-7-10-20(18-13)14-3-1-2-4-14/h7,10,12,14H,1-6,8-9,11H2,(H3,16,17)
InChIKeyMOAACSOIXUAZQT-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.15
Rot. Bonds4

About 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide

1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide (PubChem CID 64783767) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide.

Molecular Properties

Compound Name1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide
PubChem CID64783767
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide
SMILES[H]/N=C(\N)C1CCN(Cc2ccn(C3CCCC3)n2)CC1
InChIInChI=1S/C15H25N5/c16-15(17)12-5-8-19(9-6-12)11-13-7-10-20(18-13)14-3-1-2-4-14/h7,10,12,14H,1-6,8-9,11H2,(H3,16,17)
InChIKeyMOAACSOIXUAZQT-UHFFFAOYSA-N
XLogP2.15
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-3-carbothioamide
CID 64801483
1-[(1-cyclohexylpyrazol-3-yl)methyl]pyrrolidine-3-carboxylic acid
CID 64784230
1-[(1-cyclohexylpyrazol-3-yl)methyl]piperidine-4-carbaldehyde
CID 64776943
(3S,4R)-1-[(1-cyclopentylpyrazol-3-yl)methyl]pyrrolidine-3,4-diol
CID 79410698
4-[(1-cyclopentylpyrazol-3-yl)methyl]piperazine-1-sulfonamide
CID 75382047
1-[(1-cyclopentylpyrazol-3-yl)methyl]-4-methylpiperidin-4-ol
CID 81002641
2-[4-[(1-cyclopentylpyrazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanamine
CID 64801952
2-[4-[(1-cyclopentylpyrazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanol
CID 64777495
2-[4-[(1-cyclopentylpyrazol-3-yl)methyl]piperazin-1-yl]acetic acid
CID 64785188
(3S,4R)-1-[(1-cyclohexylpyrazol-3-yl)methyl]pyrrolidine-3,4-diol
CID 79410877
1-[(1-cyclopentylpyrazol-3-yl)methyl]-N-ethylpiperidin-4-amine
CID 64801540
N-[1-[(1-cyclohexylpyrazol-3-yl)methyl]piperidin-4-ylidene]hydroxylamine
CID 64784735

Frequently Asked Questions

What is the IUPAC name of 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide?
The IUPAC name of 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide (CID 64783767) is 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide.
What is the SMILES notation for 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide?
The canonical SMILES for 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide is [H]/N=C(\N)C1CCN(Cc2ccn(C3CCCC3)n2)CC1.
What is the InChIKey of 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide?
The InChIKey is MOAACSOIXUAZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c16-15(17)12-5-8-19(9-6-12)11-13-7-10-20(18-13)14-3-1-2-4-14/h7,10,12,14H,1-6,8-9,11H2,(H3,16,17).
What are the key properties of 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide?
1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide has a molecular weight of 275.40 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-cyclopentylpyrazol-3-yl)methyl]piperidine-4-carboximidamide is sourced from PubChem (CID 64783767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).