N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine

C12H19N5 — CID 113296634

IUPACN',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
SMILESCCN(CC)CCNc1ccn2nccc2n1
InChIInChI=1S/C12H19N5/c1-3-16(4-2)10-8-13-11-6-9-17-12(15-11)5-7-14-17/h5-7,9H,3-4,8,10H2,1-2H3,(H,13,15)
InChIKeyRDJDXRZNNDWOFM-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.48
Rot. Bonds6

About N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine

N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine (PubChem CID 113296634) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
PubChem CID113296634
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC NameN',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
SMILESCCN(CC)CCNc1ccn2nccc2n1
InChIInChI=1S/C12H19N5/c1-3-16(4-2)10-8-13-11-6-9-17-12(15-11)5-7-14-17/h5-7,9H,3-4,8,10H2,1-2H3,(H,13,15)
InChIKeyRDJDXRZNNDWOFM-UHFFFAOYSA-N
XLogP1.48
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372327
N'-methyl-N'-phenyl-N-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372311
N-but-3-ynylpyrazolo[1,5-a]pyrimidin-5-amine
CID 115372581
N-(3-methoxypropyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372342
N-(3-methylsulfanylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372575
2-methyl-1-(pyrazolo[1,5-a]pyrimidin-5-ylamino)propan-2-ol
CID 115372604
N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372598
N-(2-phenylsulfanylethyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372397
N-[2-(3-methylbutoxy)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 113296697
2-N,9-N-bis[2-(diethylamino)ethyl]-1,10-phenanthroline-2,9-diamine
CID 100984113
6-N-[2-(diethylamino)ethyl]pyridine-2,6-diamine
CID 10856706
N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine
CID 29034391

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine (CID 113296634) is N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine is CCN(CC)CCNc1ccn2nccc2n1.
What is the InChIKey of N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
The InChIKey is RDJDXRZNNDWOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-3-16(4-2)10-8-13-11-6-9-17-12(15-11)5-7-14-17/h5-7,9H,3-4,8,10H2,1-2H3,(H,13,15).
What are the key properties of N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine has a molecular weight of 233.32 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine is sourced from PubChem (CID 113296634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).