N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine

C15H24N6 — CID 133271576

IUPACN-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCC1CCCC(CNc2ncnc3[nH]ncc23)(N(C)C)C1
InChIInChI=1S/C15H24N6/c1-11-5-4-6-15(7-11,21(2)3)9-16-13-12-8-19-20-14(12)18-10-17-13/h8,10-11H,4-7,9H2,1-3H3,(H2,16,17,18,19,20)
InChIKeyMBWVPEZXUPCMNK-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.28
Rot. Bonds4

About N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine

N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 133271576) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID133271576
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC NameN-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCC1CCCC(CNc2ncnc3[nH]ncc23)(N(C)C)C1
InChIInChI=1S/C15H24N6/c1-11-5-4-6-15(7-11,21(2)3)9-16-13-12-8-19-20-14(12)18-10-17-13/h8,10-11H,4-7,9H2,1-3H3,(H2,16,17,18,19,20)
InChIKeyMBWVPEZXUPCMNK-UHFFFAOYSA-N
XLogP2.28
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine (CID 133271576) is N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine is CC1CCCC(CNc2ncnc3[nH]ncc23)(N(C)C)C1.
What is the InChIKey of N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is MBWVPEZXUPCMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-11-5-4-6-15(7-11,21(2)3)9-16-13-12-8-19-20-14(12)18-10-17-13/h8,10-11H,4-7,9H2,1-3H3,(H2,16,17,18,19,20).
What are the key properties of N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 288.40 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 133271576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).