7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride

C13H25ClN4O2 — CID 119767680

IUPAC7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride
SMILESCOCCn1ccc(NC(=O)CCCCCCN)n1.Cl
InChIInChI=1S/C13H24N4O2.ClH/c1-19-11-10-17-9-7-12(16-17)15-13(18)6-4-2-3-5-8-14;/h7,9H,2-6,8,10-11,14H2,1H3,(H,15,16,18);1H
InChIKeyCMBLYFITBLLRCL-UHFFFAOYSA-N
MW304.82 g/mol
LogP1.80
Rot. Bonds10

About 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride

7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride (PubChem CID 119767680) has the molecular formula C13H25ClN4O2 and a molecular weight of 304.82 g/mol. Its IUPAC name is 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride.

Molecular Properties

Compound Name7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride
PubChem CID119767680
Molecular FormulaC13H25ClN4O2
Molecular Weight304.82 g/mol
Exact Mass304.17
IUPAC Name7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride
SMILESCOCCn1ccc(NC(=O)CCCCCCN)n1.Cl
InChIInChI=1S/C13H24N4O2.ClH/c1-19-11-10-17-9-7-12(16-17)15-13(18)6-4-2-3-5-8-14;/h7,9H,2-6,8,10-11,14H2,1H3,(H,15,16,18);1H
InChIKeyCMBLYFITBLLRCL-UHFFFAOYSA-N
XLogP1.80
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.82
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]heptanamide;dihydrochloride
CID 119870128
N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide
CID 118519251
N-[1-(2-methoxyethyl)pyrazol-3-yl]-2-(methylamino)acetamide
CID 119767695
3-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]-3-phenylpropanamide;hydrochloride
CID 119951054
2-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]pentanamide;hydrochloride
CID 119314328
2-(1-hydroxycyclopentyl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide
CID 111432629
(2S,5R)-5-(aminomethyl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]oxolane-2-carboxamide;hydrochloride
CID 120791533
4-amino-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]butanamide
CID 119871291
5-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]-2-methylbenzamide
CID 120630096
N-[1-(2-methoxyethyl)pyrazol-3-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 119314318
N-[1-(2-methoxyethyl)pyrazol-3-yl]-2-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)acetamide
CID 166380020
6-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]hexanamide
CID 43704143

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride?
The IUPAC name of 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride (CID 119767680) is 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride.
What is the SMILES notation for 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride?
The canonical SMILES for 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride is COCCn1ccc(NC(=O)CCCCCCN)n1.Cl.
What is the InChIKey of 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride?
The InChIKey is CMBLYFITBLLRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2.ClH/c1-19-11-10-17-9-7-12(16-17)15-13(18)6-4-2-3-5-8-14;/h7,9H,2-6,8,10-11,14H2,1H3,(H,15,16,18);1H.
What are the key properties of 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride?
7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride has a molecular weight of 304.82 g/mol, XLogP of 1.80, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]heptanamide;hydrochloride is sourced from PubChem (CID 119767680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).