N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine

C16H25N5 — CID 105119127

IUPACN-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
SMILESCCCNC(CCc1c(C)nn(C)c1C)c1cncnc1
InChIInChI=1S/C16H25N5/c1-5-8-19-16(14-9-17-11-18-10-14)7-6-15-12(2)20-21(4)13(15)3/h9-11,16,19H,5-8H2,1-4H3
InChIKeyGGYMQHMBEYWTPF-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.50
Rot. Bonds7

About N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine

N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine (PubChem CID 105119127) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine.

Molecular Properties

Compound NameN-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
PubChem CID105119127
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC NameN-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
SMILESCCCNC(CCc1c(C)nn(C)c1C)c1cncnc1
InChIInChI=1S/C16H25N5/c1-5-8-19-16(14-9-17-11-18-10-14)7-6-15-12(2)20-21(4)13(15)3/h9-11,16,19H,5-8H2,1-4H3
InChIKeyGGYMQHMBEYWTPF-UHFFFAOYSA-N
XLogP2.50
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-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

1-(3-methylthiophen-2-yl)-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105166584
6-methyl-N-propyl-1-(1,3,5-trimethylpyrazol-4-yl)heptan-3-amine
CID 105127219
N-propyl-1-(1,3,5-trimethylpyrazol-4-yl)nonan-3-amine
CID 105126410
[1-pyridin-3-yl-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105287115
1-cyclobutyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105187556
[1-(5-fluoro-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105288178
[1-(1-propylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105288593
N-propyl-1-(1,3,5-trimethylpyrazol-4-yl)oct-6-yn-3-amine
CID 105181594
1-(1-ethylpyrazol-4-yl)-N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105109061
[1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105305907
N-[1-(3-fluoro-4-pyridinyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]propan-1-amine
CID 105181891
5,5-dimethyl-N-propyl-1-pyrimidin-5-ylhexan-1-amine
CID 114211038

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
The IUPAC name of N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine (CID 105119127) is N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine.
What is the SMILES notation for N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
The canonical SMILES for N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine is CCCNC(CCc1c(C)nn(C)c1C)c1cncnc1.
What is the InChIKey of N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
The InChIKey is GGYMQHMBEYWTPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-5-8-19-16(14-9-17-11-18-10-14)7-6-15-12(2)20-21(4)13(15)3/h9-11,16,19H,5-8H2,1-4H3.
What are the key properties of N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine has a molecular weight of 287.41 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-pyrimidin-5-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine is sourced from PubChem (CID 105119127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).