5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine

C19H30N6 — CID 71462243

IUPAC5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine
SMILESNC1CCC(Nc2cc(NCC3CCCCC3)n3nccc3n2)CC1
InChIInChI=1S/C19H30N6/c20-15-6-8-16(9-7-15)23-17-12-19(25-18(24-17)10-11-22-25)21-13-14-4-2-1-3-5-14/h10-12,14-16,21H,1-9,13,20H2,(H,23,24)
InChIKeyFPYUGZDITUVTSF-UHFFFAOYSA-N
MW342.49 g/mol
LogP3.40
Rot. Bonds5

About 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine

5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine (PubChem CID 71462243) has the molecular formula C19H30N6 and a molecular weight of 342.49 g/mol. Its IUPAC name is 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine.

Molecular Properties

Compound Name5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine
PubChem CID71462243
Molecular FormulaC19H30N6
Molecular Weight342.49 g/mol
Exact Mass342.25
IUPAC Name5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine
SMILESNC1CCC(Nc2cc(NCC3CCCCC3)n3nccc3n2)CC1
InChIInChI=1S/C19H30N6/c20-15-6-8-16(9-7-15)23-17-12-19(25-18(24-17)10-11-22-25)21-13-14-4-2-1-3-5-14/h10-12,14-16,21H,1-9,13,20H2,(H,23,24)
InChIKeyFPYUGZDITUVTSF-UHFFFAOYSA-N
XLogP3.40
TPSA80.27 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.49
LogP ≤ 53.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine with MolForge

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Related Compounds

5-[(4-Aminocyclohexyl)amino]-7-(propan-2-ylamino)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 24971313
N-octylpyrazolo[1,5-a]pyrimidin-7-amine;hydrochloride
CID 12366057
[4-[[3-Cyano-7-(propan-2-ylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexyl]azanium
CID 72199395
5-Chloro-N-decylpyrazolo[1,5-A]pyrimidin-7-amine
CID 12366064
5-N-(4-aminocyclohexyl)-7-N-(3-methylbutyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine
CID 71453355
5-chloro-N-cycloheptylpyrazolo[1,5-a]pyrimidin-7-amine
CID 134794399
5-chloro-N-(cycloheptylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 134795202
5-chloro-N-cyclohexylpyrazolo[1,5-a]pyrimidin-7-amine
CID 58314861
5-chloro-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 134792623
5-chloro-N-(2-cyclohexylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 134794171
N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide
CID 134800292
N-[(1S)-1-cyclobutylpentyl]-4-pyrazol-1-ylpyrimidin-2-amine
CID 96539265

Frequently Asked Questions

What is the IUPAC name of 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine?
The IUPAC name of 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine (CID 71462243) is 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine.
What is the SMILES notation for 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine?
The canonical SMILES for 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine is NC1CCC(Nc2cc(NCC3CCCCC3)n3nccc3n2)CC1.
What is the InChIKey of 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine?
The InChIKey is FPYUGZDITUVTSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N6/c20-15-6-8-16(9-7-15)23-17-12-19(25-18(24-17)10-11-22-25)21-13-14-4-2-1-3-5-14/h10-12,14-16,21H,1-9,13,20H2,(H,23,24).
What are the key properties of 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine?
5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine has a molecular weight of 342.49 g/mol, XLogP of 3.40, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(4-aminocyclohexyl)-7-N-(cyclohexylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine is sourced from PubChem (CID 71462243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).