3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine

C22H32N6 — CID 11153216

IUPAC3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)cnn12
InChIInChI=1S/C22H32N6/c1-8-10-27(11-9-2)20-13-16(4)24-22-18(14-23-28(20)22)21-15(3)12-19(26(6)7)25-17(21)5/h12-14H,8-11H2,1-7H3
InChIKeyYUSMUHCLTFNPGE-UHFFFAOYSA-N
MW380.54 g/mol
LogP4.41
Rot. Bonds7

About 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine

3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 11153216) has the molecular formula C22H32N6 and a molecular weight of 380.54 g/mol. Its IUPAC name is 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID11153216
Molecular FormulaC22H32N6
Molecular Weight380.54 g/mol
Exact Mass380.27
IUPAC Name3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)cnn12
InChIInChI=1S/C22H32N6/c1-8-10-27(11-9-2)20-13-16(4)24-22-18(14-23-28(20)22)21-15(3)12-19(26(6)7)25-17(21)5/h12-14H,8-11H2,1-7H3
InChIKeyYUSMUHCLTFNPGE-UHFFFAOYSA-N
XLogP4.41
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine (CID 11153216) is 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine is CCCN(CCC)c1cc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)cnn12.
What is the InChIKey of 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is YUSMUHCLTFNPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N6/c1-8-10-27(11-9-2)20-13-16(4)24-22-18(14-23-28(20)22)21-15(3)12-19(26(6)7)25-17(21)5/h12-14H,8-11H2,1-7H3.
What are the key properties of 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine?
3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 380.54 g/mol, XLogP of 4.41, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-5-methyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 11153216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).