N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine

C17H26N4O — CID 95869066

IUPACN,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(N(C)CCC[C@H]2CCCO2)n2nc(C)c(C)c2n1
InChIInChI=1S/C17H26N4O/c1-12-11-16(21-17(18-12)13(2)14(3)19-21)20(4)9-5-7-15-8-6-10-22-15/h11,15H,5-10H2,1-4H3/t15-/m0/s1
InChIKeyUOZTXBBNFWCHCK-HNNXBMFYSA-N
MW302.42 g/mol
LogP3.05
Rot. Bonds5

About N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine

N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 95869066) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID95869066
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC NameN,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(N(C)CCC[C@H]2CCCO2)n2nc(C)c(C)c2n1
InChIInChI=1S/C17H26N4O/c1-12-11-16(21-17(18-12)13(2)14(3)19-21)20(4)9-5-7-15-8-6-10-22-15/h11,15H,5-10H2,1-4H3/t15-/m0/s1
InChIKeyUOZTXBBNFWCHCK-HNNXBMFYSA-N
XLogP3.05
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,2,3,5-tetramethyl-N-[[(2S)-oxan-2-yl]methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95869657
4-N-methyl-4-N-[3-(oxolan-2-yl)propyl]benzene-1,4-diamine
CID 65162618
N-(2-chloroethyl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
CID 65165670
N-butyl-3-(4-chlorophenyl)-N,2,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 4144297
6-cyclopentyl-N,1-dimethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[5,4-d]pyrimidin-4-amine
CID 95867838
N-methyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]-3-(oxolan-2-yl)propan-1-amine
CID 77082731
5,7-dimethyl-2-[[(2S)-oxolan-2-yl]methyl]-[1,2,4]triazolo[4,3-c]pyrimidin-3-one
CID 95095149
2-methyl-1-[3-(oxolan-2-yl)propyl]indole
CID 65165792
N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-[(2S)-oxolan-2-yl]propan-1-amine
CID 124842324
3-[methyl-[3-(oxolan-2-yl)propyl]amino]benzonitrile
CID 65161053
N'-methyl-N-[3-(oxolan-2-yl)propyl]-N'-phenylpropane-1,3-diamine
CID 65163921
4-[4-(dimethylamino)phenyl]-N-methyl-N-[3-(oxolan-2-yl)propyl]pyrimidin-2-amine
CID 162626614

Frequently Asked Questions

What is the IUPAC name of N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 95869066) is N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine is Cc1cc(N(C)CCC[C@H]2CCCO2)n2nc(C)c(C)c2n1.
What is the InChIKey of N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is UOZTXBBNFWCHCK-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-12-11-16(21-17(18-12)13(2)14(3)19-21)20(4)9-5-7-15-8-6-10-22-15/h11,15H,5-10H2,1-4H3/t15-/m0/s1.
What are the key properties of N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 302.42 g/mol, XLogP of 3.05, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3,5-tetramethyl-N-[3-[(2S)-oxolan-2-yl]propyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 95869066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).