N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine

C11H18N6 — CID 63200003

IUPACN-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine
SMILESCCCNC(C)C(C)c1cncc2nnnn12
InChIInChI=1S/C11H18N6/c1-4-5-13-9(3)8(2)10-6-12-7-11-14-15-16-17(10)11/h6-9,13H,4-5H2,1-3H3
InChIKeyANPFDEGLXYZGJM-UHFFFAOYSA-N
MW234.31 g/mol
LogP1.01
Rot. Bonds5

About N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine

N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine (PubChem CID 63200003) has the molecular formula C11H18N6 and a molecular weight of 234.31 g/mol. Its IUPAC name is N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine.

Molecular Properties

Compound NameN-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine
PubChem CID63200003
Molecular FormulaC11H18N6
Molecular Weight234.31 g/mol
Exact Mass234.16
IUPAC NameN-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine
SMILESCCCNC(C)C(C)c1cncc2nnnn12
InChIInChI=1S/C11H18N6/c1-4-5-13-9(3)8(2)10-6-12-7-11-14-15-16-17(10)11/h6-9,13H,4-5H2,1-3H3
InChIKeyANPFDEGLXYZGJM-UHFFFAOYSA-N
XLogP1.01
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.31
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-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

5-(3-chlorobutan-2-yl)tetrazolo[1,5-a]pyrazine
CID 63202766
N-propyl-1-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine
CID 63202265
N-[1-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-yl)ethyl]propan-1-amine
CID 63199440
N-[2-(tetrazolo[1,5-a]pyrazin-5-yloxy)ethyl]propan-2-amine
CID 62348428
N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine
CID 62586413
N-methyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine
CID 62659503
2-methyl-5-(tetrazolo[1,5-a]pyrazin-5-ylamino)pentanoic acid
CID 104683126
2-[(tetrazolo[1,5-a]pyrazin-5-ylamino)methyl]butanoic acid
CID 65226474
3-(5-methylpyrimidin-2-yl)-N-propylbutan-2-amine
CID 63206017
1-(tetrazolo[1,5-a]pyrazin-5-yl)pentan-2-one
CID 63199240
4-methyl-3-(1-methyltetrazol-5-yl)-N-propylpentan-2-amine
CID 63197289
3-(5-bromopyrimidin-2-yl)-N-propylbutan-2-amine
CID 63873435

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine?
The IUPAC name of N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine (CID 63200003) is N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine.
What is the SMILES notation for N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine?
The canonical SMILES for N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine is CCCNC(C)C(C)c1cncc2nnnn12.
What is the InChIKey of N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine?
The InChIKey is ANPFDEGLXYZGJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6/c1-4-5-13-9(3)8(2)10-6-12-7-11-14-15-16-17(10)11/h6-9,13H,4-5H2,1-3H3.
What are the key properties of N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine?
N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine has a molecular weight of 234.31 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine is sourced from PubChem (CID 63200003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).