3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine

C14H27N3 — CID 105025716

IUPAC3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccn(C)n1)C(C)(C)CC
InChIInChI=1S/C14H27N3/c1-6-9-15-13(14(3,4)7-2)11-12-8-10-17(5)16-12/h8,10,13,15H,6-7,9,11H2,1-5H3
InChIKeyUBVMWKJNXLVTIE-UHFFFAOYSA-N
MW237.39 g/mol
LogP2.77
Rot. Bonds7

About 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine

3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine (PubChem CID 105025716) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine
PubChem CID105025716
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccn(C)n1)C(C)(C)CC
InChIInChI=1S/C14H27N3/c1-6-9-15-13(14(3,4)7-2)11-12-8-10-17(5)16-12/h8,10,13,15H,6-7,9,11H2,1-5H3
InChIKeyUBVMWKJNXLVTIE-UHFFFAOYSA-N
XLogP2.77
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine 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-[1,2-bis(1-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 82876021
1-N,1-N-dimethyl-3-(1-methylpyrazol-3-yl)-2-N-propylpropane-1,2-diamine
CID 82877837
1-(1-butan-2-ylpyrazol-3-yl)-3,3-dimethyl-N-propylbutan-2-amine
CID 64777425
1-(1-methylpyrazol-3-yl)-3-propan-2-ylsulfanyl-N-propylpropan-2-amine
CID 82878098
N,N-diethyl-3-hydrazinyl-2-methyl-4-(1-methylpyrazol-3-yl)butan-2-amine
CID 105239262
N-[2-(1-methylpyrazol-3-yl)-1-(2-methyl-4-pyridinyl)ethyl]propan-1-amine
CID 106755739
3-methyl-4-(1-methylpyrazol-3-yl)-N-propylbutan-1-amine
CID 82882611
N-ethyl-4,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine
CID 82876652
N-[2-(1-methylpyrazol-3-yl)-1-(4-methylsulfanylphenyl)ethyl]propan-1-amine
CID 105025379
N-[1-(4-bromo-3,5-dimethylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 114330797
1-(1-methylpyrazol-3-yl)-N-propyl-3-thiophen-2-ylpropan-2-amine
CID 82876479
N,N-dimethyl-1-[2-(1-methylpyrazol-3-yl)-1-(propylamino)ethyl]cyclopentan-1-amine
CID 82876946

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine?
The IUPAC name of 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine (CID 105025716) is 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine.
What is the SMILES notation for 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine?
The canonical SMILES for 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine is CCCNC(Cc1ccn(C)n1)C(C)(C)CC.
What is the InChIKey of 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine?
The InChIKey is UBVMWKJNXLVTIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-6-9-15-13(14(3,4)7-2)11-12-8-10-17(5)16-12/h8,10,13,15H,6-7,9,11H2,1-5H3.
What are the key properties of 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine?
3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine has a molecular weight of 237.39 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(1-methylpyrazol-3-yl)-N-propylpentan-2-amine is sourced from PubChem (CID 105025716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).