N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide

C15H26N4O — CID 103115758

IUPACN-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide
SMILESCn1ccc(C(=O)N(CCCN)C2CCCCCC2)n1
InChIInChI=1S/C15H26N4O/c1-18-12-9-14(17-18)15(20)19(11-6-10-16)13-7-4-2-3-5-8-13/h9,12-13H,2-8,10-11,16H2,1H3
InChIKeyPWASCVXFLRUEEC-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.93
Rot. Bonds5

About N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide

N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide (PubChem CID 103115758) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide
PubChem CID103115758
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide
SMILESCn1ccc(C(=O)N(CCCN)C2CCCCCC2)n1
InChIInChI=1S/C15H26N4O/c1-18-12-9-14(17-18)15(20)19(11-6-10-16)13-7-4-2-3-5-8-13/h9,12-13H,2-8,10-11,16H2,1H3
InChIKeyPWASCVXFLRUEEC-UHFFFAOYSA-N
XLogP1.93
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide 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

N-(2-aminoethyl)-N-cyclopropyl-1-methylpyrazole-3-carboxamide
CID 103115823
N-(2-chloroethyl)-N-cyclopropyl-1-methylpyrazole-3-carboxamide
CID 103122400
N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide
CID 43136887
N-(3-aminopropyl)-N-cyclopentyl-1,3-dimethylpyrazole-4-carboxamide
CID 102801032
N-(3-aminopropyl)-N-cycloheptylpyridazine-4-carboxamide
CID 104668877
N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide
CID 43319374
N-[2-(aminomethyl)cyclohexyl]-N-ethyl-1-methylpyrazole-3-carboxamide
CID 103120889
N-(3-aminopropyl)-N-cyclopentyl-3-ethyl-1-methylpyrazole-4-carboxamide
CID 102809889
N-(3-aminopropyl)-N-cyclohexylpyridine-3-carboxamide
CID 43319410
N-(3-aminopropyl)-N-cycloheptylfuran-3-carboxamide
CID 43136891
N-(3-aminopropyl)-N-cyclopentylpyridine-3-carboxamide
CID 43136838
N-(3-aminopropyl)-N-cycloheptyl-2-methylpyridine-4-carboxamide
CID 106752285

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide?
The IUPAC name of N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide (CID 103115758) is N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide?
The canonical SMILES for N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide is Cn1ccc(C(=O)N(CCCN)C2CCCCCC2)n1.
What is the InChIKey of N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide?
The InChIKey is PWASCVXFLRUEEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-18-12-9-14(17-18)15(20)19(11-6-10-16)13-7-4-2-3-5-8-13/h9,12-13H,2-8,10-11,16H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide?
N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide is sourced from PubChem (CID 103115758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).